Summary
Nanoscale Physics Development
paquets de développement Debian pour les nanosciences
CE méta-paquet installera les paquets scientifiques qui pourraient être
utiles au développement d'applications pour les nanosciences.
Vous pourriez également être intéressé(e) par les paquets marqués avec
« field:physics » et suivant vos attentes, par les méta-paquets
« nanoscale-physics », « science-physics » et « education-physics ».
Description
For a better overview of the project's availability as a Debian package, each head row has a color code according to this scheme:
If you discover a project which looks like a good candidate for Debian Science
to you, or if you have prepared an unofficial Debian package, please do not hesitate to
send a description of that project to the Debian Science mailing list
Links to other tasks
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Debian Science Nanoscale Physics Development packages
Official Debian packages with high relevance
abinit-doc
paquet pour les calculs de structure électronique − documentation
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Versions of package abinit-doc |
Release | Version | Architectures |
bookworm | 9.6.2-1 | all |
bullseye | 9.2.2-1 | all |
buster | 8.8.4-2 | all |
stretch | 8.0.8-1 | all |
jessie | 7.8.2-2 | all |
sid | 9.10.4-3 | all |
upstream | 10.3.3 |
Debtags of package abinit-doc: |
made-of | html, pdf, tex |
role | documentation |
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License: DFSG free
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ABINIT est un paquet dont le programme principal permet de trouver
l'énergie totale, la densité de charge et la structure électronique de
systèmes composés d'électrons et de noyaux (molécules et solides
périodiques) dans le cadre de la théorie fonctionnelle de la densité
(DFT, « Density Functional Theory ») en utilisant des pseudo-potentiels et
une base d'onde plane.
ABINIT inclut également des options pour optimiser la géométrie suivant les
forces et stress de la DFT, pour faire des simulations de dynamique
moléculaire en utilisant ces forces ou pour créer des matrices
dynamiques, des charges effectives de Born et des tenseurs diélectriques.
Les états excités peuvent être calculés suivant la DFT dépendante du temps
(pour les molécules) ou suivant la théorie des perturbations multicorps
(l'approximation GW). En plus du code principal d'ABINIT, différents
utilitaires sont fournis.
Ce paquet fournit la documentation et les tutoriels.
Please cite:
X. Gonze, B. Amadon, P.-M. Anglade, J.-M. Beuken, F. Bottin, P. Boulanger, F. Bruneval, D. Caliste, R. Caracas, M. Côté, T. Deutsch, L. Genovese, Ph. Ghosez, M. Giantomassi, S. Goedecker, D.R. Hamann, P. Hermet, F. Jollet, G. Jomard, S. Leroux, M. Mancini, S. Mazevet, M. J. T. Oliveira, G. Onida, Y. Pouillon, T. Rangel, G.-M. Rignanese, D. Sangalli, R. Shaltaf, M. Torrent, M. J. Verstraete, G. Zerah and J. W. Zwanziger:
ABINIT: First-principles approach to material and nanosystem properties.
(eprint)
Comput. Phys. Commun.
180(12):2582-2615
(2009)
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gsl-bin
Bibliothèque scientifique GNU (GSL, GNU Scientific Library) : binaires
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Versions of package gsl-bin |
Release | Version | Architectures |
bullseye | 2.6+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 2.8+dfsg-5 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 2.8+dfsg-5 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm-proposed-updates | 2.7.1+dfsg-5+deb12u1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
stretch | 2.3+dfsg-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bookworm | 2.7.1+dfsg-5 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 2.5+dfsg-6 | amd64,arm64,armhf,i386 |
buster-security | 2.5+dfsg-6+deb10u1 | amd64,arm64,armhf,i386 |
jessie | 1.16+dfsg-2 | amd64,armel,armhf,i386 |
bullseye-security | 2.6+dfsg-2+deb11u1 | amd64,arm64,armhf,i386 |
Debtags of package gsl-bin: |
devel | lang:c |
field | mathematics |
interface | commandline |
role | program |
scope | utility |
suite | gnu |
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License: DFSG free
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La bibliothèque scientifique GNU (GSL, GNU Scientific Library) est une
collection de routines pour l'analyse numérique. Les routines sont écrites
en totalité par l'équipe GSL en C et présentent une interface de
programmation (API) moderne pour les programmeurs C, tout en permettant
d'écrire des adaptateurs pour des langages de très haut niveau.
Ce paquet fournit plusieurs exemples de binaires.
Page d'accueil : http://www.gnu.org/software/gsl/
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libblas-dev
Basic Linear Algebra Subroutines 3, bibliothèque statique
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Versions of package libblas-dev |
Release | Version | Architectures |
bookworm | 3.11.0-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 3.12.0-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
stretch | 3.7.0-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bullseye | 3.9.0-3+deb11u1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
jessie | 1.2.20110419-10 | amd64,armel,armhf,i386 |
buster | 3.8.0-2 | amd64,arm64,armhf,i386 |
sid | 3.12.0-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
Debtags of package libblas-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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Ce paquet est une mise à niveau incompatible sur le plan binaire avec le
paquet blas-dev. Plusieurs modifications mineures de l'interface⋅C ont été
introduites.
BLAS (Basic Linear Algebra Subroutines) est un ensemble de sous-programmes
performants permettant d'effectuer la plupart des opérations de base sur
les vecteurs et les matrices. Ces sous-programmes sont largement utilisés
comme base par d'autres logiciels d'algèbre linéaire de haute qualité, par
exemple lapack et linpack. Cette mise en œuvre est celle de référence
trouvée sur netlib.org et codée en Fortran 77.
Ce paquet fournit une version statique de la bibliothèque.
Please cite:
E. Anderson, Z. Bai, C. Bischof, S. Blackford, J. Demmel, J. Dongarra, J. Du Croz, A. Greenbaum, S. Hammarling, A. McKenney and D. Sorensen:
LAPACK Users' Guide
(1999)
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libcbf-dev
fichiers de développement pour CBFlib
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Versions of package libcbf-dev |
Release | Version | Architectures |
bookworm | 0.9.7+dfsg1-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 0.9.7+dfsg1-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster | 0.9.5.18+dfsg1-1 | amd64,arm64,armhf,i386 |
jessie | 0.9.2.2-1 | amd64,armel,armhf,i386 |
trixie | 0.9.7+dfsg1-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
stretch | 0.9.2.2-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bullseye | 0.9.6+dfsg1-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
Debtags of package libcbf-dev: |
devel | library |
field | biology:structural |
hardware | scanner |
role | devel-lib |
works-with | image, image:raster |
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License: DFSG free
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CBFlib est une bibliothèque de fonctions en ANSI-C fournissant un mécanisme
simple pour lire des fichiers binaires cristallographiques (CBF) et des
fichiers d'images CIF (imgCIF). L'API CBFLIB est plus ou moins basée sur
l'API CIFPARSE pour les fichiers mmCIF. CBFLIB ne réalise aucune
vérification d'intégrité sémantique, mais fournit simplement des fonctions
pour créer, lire, modifier et écrire des fichiers de données binaires CBF
et des fichiers de données ASCII imgCIF.
Ce paquet fournit les bibliothèques et fichiers d'en-tête pour le
développement de programme.
The package is enhanced by the following packages:
cbflib-doc
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libccp4-dev
CCP4 core functionality - development files
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Versions of package libccp4-dev |
Release | Version | Architectures |
jessie | 6.4.5-2 | amd64,armel,armhf,i386 |
stretch | 6.4.5-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 6.5.1-1 | amd64,arm64,armhf,i386 |
bullseye | 6.5.1-5 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 8.0.0-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 8.0.0-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 8.0.0-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
Debtags of package libccp4-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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The CCP4 software suite is based around a library of routines which
cover common tasks, such as file opening, parsing keyworded input,
reading and writing of standard data formats, applying symmetry
operations, etc. Programs in the suite call these routines which, as
well as saving the programmer some effort, ensure that the varied
programs in the suite have a similar look-and-feel.
The library contains several sub components:
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CMTZ library -- Contains a variety of functions for manipulating
the data structure, for example adding crystals, datasets or
columns. The data structure can be dumped to an output MTZ data
file.
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CMAP library -- Functions defining the C-level API for accessing
CCP4 map files.
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CSYM library -- a collection of functions centered around a data
file syminfo.lib which is auto-generated from sgtbx (the Space
Group Toolbox of cctbx).
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CCP4 utility library -- many utility functions which either give
specific CCP4 or platform independent functionality.
-
CCP4 Parser library -- provides CCP4-style parsing, as used for
processing keywords of CCP4 programs, MTZ header records, etc.
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CCP4 resizable arrays -- defines an object and methods which looks
just like a simple C array, but can be resized at will without
incurring excessive overheads.
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libcctbx-dev
Computational Crystallography Toolbox - headers
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Versions of package libcctbx-dev |
Release | Version | Architectures |
bookworm | 2022.9+ds2+~3.11.2+ds1-6 | amd64,arm64,ppc64el,s390x |
trixie | 2024.10+ds2+~3.22.1+ds1-4 | amd64,arm64,ppc64el,riscv64,s390x |
sid | 2024.10+ds2+~3.22.1+ds1-4 | amd64,arm64,ppc64el,riscv64,s390x |
upstream | 2024.11+~3.22.1 |
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License: DFSG free
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Computational Crystallography Toolbox contains following modules:
- annlib_adaptbx:
- boost_adaptbx: wrappers for Boost functionality in CCTBX
- cbflib_adaptbx:
- ccp4io_adaptbx:
- cctbx: Libraries for general crystallographic applications,
useful for both small-molecule and macro-molecular
crystallography.
- cma_es:
- crys3d: Modules for the display of molecules, electron density,
and reciprocal space data.
- dxtbx: The Diffraction Image Toolbox, a library for handling
X-ray detector data of arbitrary complexity from a variety
of standard formats.
- fable: Fortran EMulation library for porting Fortran77 to C++.
- gltbx: Python bindings for OpenGL
- iotbx: Working with common crystallographic file formats.
- libtbx: The build system common to all other modules. This includes
a very thin wrapper around the SCons software construction tool.
It also contains many useful frameworks and utilities to simplify
application development, including tools for regression testing,
parallelization across multiprocessor systems and managed clusters,
and a flexible, modular configuration syntax called PHIL
(Python Hierarchial Interface Language) used throughout the CCTBX.
- mmtbx: Functionality specific to macromolecular crystallography.
This includes all of the machinery required for setup of
geometry restraints, bulk solvent correction and scaling,
analysis of macromolecular diffraction data, calculation of
weighted map coefficients, and most of the methods implemented
in phenix.refine. The majority of infrastructure for the MolProbity
validation server (and Phenix equivalent) is also located here.
- omptbx: OpenMP interface.
- rstbx: A reciprocal space toolbox to autoindex small molecule Bragg
diffraction, given the reciprocal space vectors.
- scitbx: General scientific calculations. his includes a family of
high-level C++ array types, a fast Fourier transform library,
and a C++ port of the popular L-BFGS quasi-Newton minimizer.
- smtbx: Small-Molecule crystallography.
- spotfinder:
- tbxx:
- wxtbx: wxPython controls used in the Phenix GUI and various
utilities
This package provide everythings needed to link against the cctbx libraries.
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libcexceptions-dev
C exception handling library (development files)
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Versions of package libcexceptions-dev |
Release | Version | Architectures |
bullseye | 3.1.0+dfsg-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 3.10.0+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster | 2.3+dfsg-3 | amd64,arm64,armhf,i386 |
trixie | 3.10.0+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 3.7.0+dfsg-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
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Wrappers for C functions, allowing usage of try ... catch ... blocks
in C language. Wrapped functions include memory allocation, standard
I/O and strdup.
This package contains static library and header files.
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libclipper-dev
object oriented development kit for crystallographic computing
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Versions of package libclipper-dev |
Release | Version | Architectures |
stretch | 2.1.20130601-2.1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 2.1.20160809-2 | amd64,arm64,armhf,i386 |
bullseye | 2.1.20201109-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 2.1.20201109-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
jessie | 2.1.20130601-2 | amd64,armel,armhf,i386 |
trixie | 2.1.20201109-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 2.1.20201109-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
Debtags of package libclipper-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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The aim of the clipper project is to produce a set of object-oriented
libraries for the organisation of crystallographic data and the
performance of crystallographic computation.
This package contains development environment for programs which will
use the clipper libraries.
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libcod-precision-perl
COD precision handling module for Perl language
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Versions of package libcod-precision-perl |
Release | Version | Architectures |
buster | 2.3+dfsg-3 | all |
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License: DFSG free
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COD::Precision, module for handling precision in Crystallographic
Information Format (CIF) notation, expressed as standard uncertainties
in parentheses next to the value.
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libcoordgen-dev
2D coordinate generation for chemical compounds - header files
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Versions of package libcoordgen-dev |
Release | Version | Architectures |
trixie | 3.0.2-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 3.0.2-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 3.0.1-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bullseye | 1.4.2-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
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This package provides the Open Source release of Schroedinger's routines
for the 2D coordinate representation of chemical compounds.
This package provides header files for developing against the API of that
library.
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libetsf-io-dev
Static libraries and Fortran module files of ETSF_IO
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Versions of package libetsf-io-dev |
Release | Version | Architectures |
buster | 1.0.4-4 | amd64,arm64,armhf,i386 |
jessie | 1.0.3-4 | amd64,armel,armhf,i386 |
stretch | 1.0.4-1.1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bullseye | 1.0.4-5 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 1.0.4-5 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 1.0.4-5 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 1.0.4-5 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
Debtags of package libetsf-io-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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ETSF_IO is a library of F90 routines to read/write the ETSF file format.
This package contains the static libraries provided by ETSF_IO to let
electronic structure codes read and write ETSF files. It also contains
the module file used by the Fortran compiler.
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libetsf-io-doc
Developer documentation API and tutorials for ETSF_IO
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Versions of package libetsf-io-doc |
Release | Version | Architectures |
sid | 1.0.4-5 | all |
trixie | 1.0.4-5 | all |
bookworm | 1.0.4-5 | all |
bullseye | 1.0.4-5 | all |
buster | 1.0.4-4 | all |
stretch | 1.0.4-1.1 | all |
jessie | 1.0.3-4 | all |
Debtags of package libetsf-io-doc: |
devel | doc, examples |
made-of | html |
role | documentation |
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License: DFSG free
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ETSF_IO is a library of F90 routines to read/write the ETSF file format.
This Package contains the HTML documentation of the API and some tutorials
on how to use the library in electronic structure codes.
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libfftw3-dev
bibliothèque de calcul des transformées de Fourier rapides — développement
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Versions of package libfftw3-dev |
Release | Version | Architectures |
stretch | 3.3.5-3 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 3.3.8-2 | amd64,arm64,armhf,i386 |
bullseye | 3.3.8-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 3.3.10-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
jessie | 3.3.4-2 | amd64,armel,armhf,i386 |
sid | 3.3.10-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 3.3.10-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
Debtags of package libfftw3-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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La bibliothèque FFTW calcule les transformées de Fourier rapides (FFT) en
une ou plusieurs dimensions. Elle est très rapide. Ce paquet fournit la
bibliothèque statique liée, les fichiers d'en-tête et les programmes de test.
Ce paquet fournit les fichiers d'en-tête et les bibliothèques statiques.
Pour la documentation, consultez libfftw3-doc.
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libgsl0-dev
??? missing short description for package libgsl0-dev :-(
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Versions of package libgsl0-dev |
Release | Version | Architectures |
jessie | 1.16+dfsg-2 | amd64,armel,armhf,i386 |
Debtags of package libgsl0-dev: |
devel | lang:c, library |
field | mathematics |
role | devel-lib |
suite | gnu |
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License: DFSG free
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libhdf5-dev
HDF5 - development files - serial version
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Versions of package libhdf5-dev |
Release | Version | Architectures |
bookworm | 1.10.8+repack1-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 1.14.5+repack-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 1.10.10+repack-5 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
jessie | 1.8.13+docs-15+deb8u1 | amd64,armel,armhf,i386 |
jessie-security | 1.8.13+docs-15+deb8u1 | amd64,armel,armhf,i386 |
stretch | 1.10.0-patch1+docs-3+deb9u1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 1.10.4+repack-10 | amd64,arm64,armhf,i386 |
buster-security | 1.10.4+repack-10+deb10u1 | amd64,arm64,armhf,i386 |
bullseye | 1.10.6+repack-4+deb11u1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
Debtags of package libhdf5-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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Hierarchical Data Format 5 (HDF5) is a file format and library for
storing scientific data. HDF5 was designed and implemented to address
the deficiencies of HDF4.x. It has a more powerful and flexible data
model, supports files larger than 2 GB, and supports parallel I/O.
This package contains development files for serial platforms.
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libhepmc3-dev
Event Record for Monte Carlo Generators - development files
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Versions of package libhepmc3-dev |
Release | Version | Architectures |
bookworm | 3.1.2-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bullseye | 3.1.2-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 3.1.2-2.1 | amd64,arm64,armel,armhf,mips64el,ppc64el,riscv64,s390x |
sid | 3.1.2-2 | i386 |
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License: DFSG free
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The HepMC package is an object oriented event record written in C++ for
High Energy Physics Monte Carlo Generators.
Many extensions from HEPEVT, the Fortran HEP standard, are supported: the
number of entries is unlimited, spin density matrices can be stored with
each vertex, flow patterns (such as color) can be stored and traced,
integers representing random number generator states can be stored, and an
arbitrary number of event weights can be included. Particles and vertices
are kept separate in a graph structure, physically similar to a physics
event.
The added information supports the modularisation of event generators.
Event information is accessed by means of iterators supplied with the
package.
This package provides development files for HepMC3.
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libkim-api-dev
Development files for KIM-API
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Versions of package libkim-api-dev |
Release | Version | Architectures |
trixie | 2.3.0-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 2.3.0-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster-backports | 2.2.1-1~bpo10+1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bullseye | 2.2.1-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 2.3.0-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
|
The KIM API is an Application Programming Interface for atomistic simulations.
The API provides a standard for exchanging information between atomistic
simulation codes (molecular dynamics, molecular statics, lattice dynamics,
Monte Carlo, etc.) and interatomic models (potentials or force fields).
It also includes a set of library routines for using the API with
bindings for:
FORTRAN 77, Fortran 90/95, Fortran 2003
C, C++
Atomistic simulation codes that support the KIM API work seamlessly with the
KIM-compliant interatomic models (KIM Models) distributed on this website.
The interface is computationally efficient and often requires relatively minor
changes to existing codes.
This package contains the development files (headers and documentation) for
KIM-API.
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liblapack-dev
bibliothèque de routines algébriques version⋅3 –⋅version statique
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Versions of package liblapack-dev |
Release | Version | Architectures |
jessie | 3.5.0-4 | amd64,armel,armhf,i386 |
sid | 3.12.0-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 3.12.0-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 3.11.0-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bullseye | 3.9.0-3+deb11u1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 3.8.0-2 | amd64,arm64,armhf,i386 |
stretch | 3.7.0-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
Debtags of package liblapack-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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LAPACK version⋅3.x est une bibliothèque FORTRAN complète qui effectue des
opérations d'algèbre linéaire, y compris l'inversion de matrice, la
résolution de la méthode des moindres carrés d'ensembles linéaires
d'équations, l'analyse de valeurs propres, la décomposition en valeurs
singulières, etc. Ce paquet très complet et reconnu est intensivement
utilisé dans la communauté scientifique.
Ce paquet fournit une version statique de la bibliothèque.
Please cite:
E. Anderson, Z. Bai, C. Bischof, S. Blackford, J. Demmel, J. Dongarra, J. Du Croz, A. Greenbaum, S. Hammarling, A. McKenney and D. Sorensen:
LAPACK Users' Guide
(1999)
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liblapack-doc
bibliothèque de routines algébriques version⋅3 –⋅documentation
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Versions of package liblapack-doc |
Release | Version | Architectures |
bookworm | 3.11.0-2 | all |
jessie | 3.5.0-4 | all |
stretch | 3.7.0-2 | all |
buster | 3.8.0-2 | all |
bullseye | 3.9.0-3+deb11u1 | all |
trixie | 3.12.0-4 | all |
sid | 3.12.0-4 | all |
Debtags of package liblapack-doc: |
devel | lang:fortran |
made-of | html, postscript |
role | documentation |
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License: DFSG free
|
LAPACK version⋅3.x est une bibliothèque FORTRAN complète qui effectue des
opérations d'algèbre linéaire, y compris l'inversion de matrice, la
résolution de la méthode des moindres carrés d'ensembles linéaires
d'équations, l'analyse de valeurs propres, la décomposition en valeurs
singulières, etc. Ce paquet très complet et reconnu est intensivement
utilisé dans la communauté scientifique.
Ce paquet fournit⋅:
–⋅les pages de manuel des routines BLAS et LAPACK⋅;
–⋅le guide de l'utilisateur de Lapack (en HTML)⋅;
–⋅le manuel de l'interface LAPACKE⋅C vers LAPACK (en PDF).
Please cite:
E. Anderson, Z. Bai, C. Bischof, S. Blackford, J. Demmel, J. Dongarra, J. Du Croz, A. Greenbaum, S. Hammarling, A. McKenney and D. Sorensen:
LAPACK Users' Guide
(1999)
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libmaeparser-dev
Development files to parse Schrödinger Maestro files
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Versions of package libmaeparser-dev |
Release | Version | Architectures |
bullseye | 1.2.4-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 1.3.0-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 1.3.1-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 1.3.1-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
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License: DFSG free
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This package provides header files to develop one's own software
that uses a library wth an Open Source parser for Maestro (.mae)
files.
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libmctc-lib-dev
modular computation tool chain library (development files)
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Versions of package libmctc-lib-dev |
Release | Version | Architectures |
sid | 0.3.2-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 0.3.1-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 0.3.2-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
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License: DFSG free
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Common tool chain for working with molecular structure data in various
applications. This library provides a unified way to perform operations on
molecular structure data, like reading and writing to common geometry file
formats.
This package contains development files.
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libmmdb2-dev
macromolecular coordinate library - development files
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Versions of package libmmdb2-dev |
Release | Version | Architectures |
bookworm | 2.0.22-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 2.0.22-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 2.0.22-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster | 2.0.5-1 | amd64,arm64,armhf,i386 |
bullseye | 2.0.5-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
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MMDB is designed to assist developers in working with macromolecular
coordinate files. The library handles both PDB and mmCIF format files.
The Library also features an internal binary format, portable between
different platforms. This is achieved at uniformity of the Library's
interface functions, so there is no difference in handling different
formats.
MMDB provides various high-level tools for working with coordinate files,
including reading and writing, orthogonal-fractional transforms,
generation of symmetry mates, editing the molecular structure and more.
This package contains library and header files needed for program
development.
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libmpich-dev
??? missing short description for package libmpich-dev :-(
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Versions of package libmpich-dev |
Release | Version | Architectures |
bookworm | 4.0.2-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 4.2.0-14 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bullseye | 3.4.1-5~deb11u1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 4.2.1-4 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
jessie | 3.1-5 | amd64,armel,armhf,i386 |
stretch | 3.2-7 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 3.3-3 | amd64,arm64,armhf,i386 |
upstream | 4.3.0~rc1 |
Debtags of package libmpich-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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libncrystal-dev
Monte Carlo simulations of neutrons in crystals (dev files)
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Versions of package libncrystal-dev |
Release | Version | Architectures |
trixie | 3.4.1+ds1-1.1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 3.4.1+ds1-1.1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 3.4.1+ds1-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
upstream | 3.9.7 |
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License: DFSG free
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This is a source distribution of NCrystal, a library and associated
tools which enables calculations for Monte Carlo simulations of
thermal neutrons in crystals.
This package contains the development files.
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libnetcdf-dev
creation, access, and sharing of scientific data
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Versions of package libnetcdf-dev |
Release | Version | Architectures |
bullseye | 4.7.4-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 4.9.0-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 4.9.2-7 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster | 4.6.2-1 | amd64,arm64,armhf,i386 |
stretch | 4.4.1.1-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
trixie | 4.9.2-7 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
experimental | 4.9.3~rc2-1~exp1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
jessie | 4.1.3-7.2 | amd64,armel,armhf,i386 |
upstream | 4.9.3~rc2 |
Debtags of package libnetcdf-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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NetCDF (network Common Data Form) is a set of interfaces for array-oriented
data access and a freely distributed collection of data access libraries for
C, Fortran, C++, Java, and other languages. The netCDF libraries support a
machine-independent format for representing scientific data. Together, the
interfaces, libraries, and format support the creation, access, and sharing of
scientific data.
This package provides headers.
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libnexus-dev
NeXus scientific data file format - development libraries
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Versions of package libnexus-dev |
Release | Version | Architectures |
trixie | 4.4.3-6 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bullseye | 4.4.3-5 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 4.4.3-6 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 4.4.3-5 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
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NeXus is a common data format for neutron, X-ray, and muon science. It
is being developed as an international standard by scientists and
programmers representing major scientific facilities in Europe, Asia,
Australia, and North America in order to facilitate greater cooperation
in the analysis and visualization of neutron, X-ray, and muon data.
This is the package containing the development libraries.
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libnexus-java
NeXus scientific data file format - java libraries
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Versions of package libnexus-java |
Release | Version | Architectures |
bullseye | 4.4.3-5 | all |
sid | 4.4.3-6 | all |
bookworm | 4.4.3-5 | all |
trixie | 4.4.3-6 | all |
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License: DFSG free
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NeXus is a common data format for neutron, X-ray, and muon science. It
is being developed as an international standard by scientists and
programmers representing major scientific facilities in Europe, Asia,
Australia, and North America in order to facilitate greater cooperation
in the analysis and visualization of neutron, X-ray, and muon data.
This is the package containing the java libraries.
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liboce-ocaf-dev
??? missing short description for package liboce-ocaf-dev :-(
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Versions of package liboce-ocaf-dev |
Release | Version | Architectures |
bullseye | 0.18.3-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 0.18.2-3 | amd64,arm64,armhf,i386 |
bookworm | 0.18.3-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
jessie | 0.15-5 | amd64,armel,armhf,i386 |
stretch | 0.17.2-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
Debtags of package liboce-ocaf-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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liboce-visualization-dev
??? missing short description for package liboce-visualization-dev :-(
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Versions of package liboce-visualization-dev |
Release | Version | Architectures |
bookworm | 0.18.3-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bullseye | 0.18.3-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 0.18.2-3 | amd64,arm64,armhf,i386 |
stretch | 0.17.2-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
jessie | 0.15-5 | amd64,armel,armhf,i386 |
Debtags of package liboce-visualization-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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libopenmpi-dev
high performance message passing library -- header files
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Versions of package libopenmpi-dev |
Release | Version | Architectures |
jessie | 1.6.5-9.1+deb8u1 | amd64,armel,armhf,i386 |
bullseye | 4.1.0-10 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 5.0.6-3 | amd64,arm64,mips64el,ppc64el,riscv64,s390x |
sid | 5.0.6-3 | amd64,arm64,mips64el,ppc64el,riscv64,s390x |
stretch | 2.0.2-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bookworm | 4.1.4-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 3.1.3-11 | amd64,arm64,armhf,i386 |
Debtags of package libopenmpi-dev: |
admin | cluster |
devel | lang:c, library |
field | mathematics |
role | devel-lib, shared-lib |
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License: DFSG free
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Open MPI is a project combining technologies and resources from several other
projects (FT-MPI, LA-MPI, LAM/MPI, and PACX-MPI) in order to build the best
MPI library available. A completely new MPI-3 compliant implementation, Open
MPI offers advantages for system and software vendors, application developers
and computer science researchers.
This package contains the header files and compiler wrappers which are needed
to compile and link programs against libopenmpi.
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libroot-math-mlp-dev
??? missing short description for package libroot-math-mlp-dev :-(
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Versions of package libroot-math-mlp-dev |
Release | Version | Architectures |
jessie | 5.34.19+dfsg-1.2 | amd64,armel,armhf,i386 |
Debtags of package libroot-math-mlp-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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libroot-montecarlo-vmc-dev
??? missing short description for package libroot-montecarlo-vmc-dev :-(
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Versions of package libroot-montecarlo-vmc-dev |
Release | Version | Architectures |
jessie | 5.34.19+dfsg-1.2 | amd64,armel,armhf,i386 |
Debtags of package libroot-montecarlo-vmc-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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libroot-tmva-dev
??? missing short description for package libroot-tmva-dev :-(
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Versions of package libroot-tmva-dev |
Release | Version | Architectures |
jessie | 5.34.19+dfsg-1.2 | amd64,armel,armhf,i386 |
Debtags of package libroot-tmva-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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libscalapack-mpi-dev
Scalable Linear Algebra Package - Dev files for MPI
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Versions of package libscalapack-mpi-dev |
Release | Version | Architectures |
trixie | 2.2.1-7 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
jessie | 1.8.0-12 | amd64,armel,armhf,i386 |
stretch | 1.8.0-13 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 2.0.2-7 | amd64,arm64,armhf,i386 |
bullseye | 2.1.0-4 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 2.2.1-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 2.2.1-7 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
Debtags of package libscalapack-mpi-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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ScaLAPACK is the parallel version of LAPACK used on clusters.
There are packages for the shared libraries, for the static libraries and
the development files (this one) and for test programs.
Also included:
- PBLAS, Parallel Basic Linear Algebra Subprograms
- BLACS, Basic Linear Algebra Communication Subprograms
This is a dummy package which depends on the scalapack development package
supporting the default implementation of MPI on this architecture.
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libsis-jhdf5-java
??? missing short description for package libsis-jhdf5-java :-(
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Versions of package libsis-jhdf5-java |
Release | Version | Architectures |
bullseye | 19.04.0+dfsg-4 | all |
bookworm | 19.04.1+dfsg-3 | all |
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License: DFSG free
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libspfft-dev
Sparse 3D FFT library with MPI, OpenMP, CUDA / ROCm support (development files)
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Versions of package libspfft-dev |
Release | Version | Architectures |
bookworm | 1.0.6-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bullseye | 0.9.13-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 1.1.0-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 1.1.0-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
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License: DFSG free
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SpFFT was originally intended for transforms of data with spherical cutoff in
frequency domain, as required by some computational material science codes.
For distributed computations, SpFFT uses a slab decomposition in space domain
and pencil decomposition in frequency domain (all sparse data within a pencil
must be on one rank). If desired, the library can be compiled without any
parallelization (MPI, OpenMP, CUDA / ROCm).
This package contains development files.
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libssm-dev
macromolecular superposition library - development files
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Versions of package libssm-dev |
Release | Version | Architectures |
sid | 1.4.0-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 1.4.0-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 1.4.0-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bullseye | 1.4.0-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 1.4.0-1 | amd64,arm64,armhf,i386 |
jessie | 1.3-2 | amd64,armel,armhf,i386 |
Debtags of package libssm-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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SSM is a macromolecular coordinate superposition library, written by
Eugene Krissinel of the EBI.
The library implements the SSM algorithm of protein structure
comparison in three dimensions, which includes an original procedure
of matching graphs built on the protein's secondary-structure
elements, followed by an iterative three-dimensional alignment of
protein backbone Calpha atoms.
This package contains libraries and header files needed for program
development.
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libsymspg-dev
C library for crystal symmetry determination (development files)
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Versions of package libsymspg-dev |
Release | Version | Architectures |
sid | 2.5.0-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 2.0.2-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 1.12.2-1 | amd64,arm64,armhf,i386 |
trixie | 2.5.0-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bullseye | 1.16.1-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
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Spglib is a C library for crystal symmetry determination. Symmetry
operations, space groups and other data can be obtained using this
symmetry finder.
Features include:
- Identify space-group type
- Find symmetry operations
- Find a primitive cell
- Search irreducible k-points
- Refine crystal structure
- Wyckoff position assignment
This package contains static library and header files.
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libufo-dev
Library for high-performance, GPU-based computing - devel
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Versions of package libufo-dev |
Release | Version | Architectures |
bookworm | 0.16.0.52.gbd831ab-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
stretch | 0.13.0-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 0.15.1-1 | amd64,arm64,armhf,i386 |
bullseye | 0.16.0.52.gbd831ab-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 0.16.0.52.gbd831ab-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 0.16.0.52.gbd831ab-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
upstream | 0.16.0.53.gce7118b |
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License: DFSG free
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The UFO data processing framework is a C library suited to build
general purpose streams data processing on heterogeneous
architectures such as CPUs, GPUs or clusters. It is extensively used
at the Karlsruhe Institute of Technology for Ultra-fast X-ray Imaging
(radiography, tomography and laminography).
A gobject-instrospection binding is also provided to write scripts or
user interfaces.
This package contain the development files for libufo.
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libxc-dev
Library of Exchange-Correlation Functionals (development files)
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Versions of package libxc-dev |
Release | Version | Architectures |
bullseye | 4.3.4-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 5.2.3-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 5.2.3-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
stretch | 3.0.0-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
jessie | 2.1.1-1 | amd64,armel,armhf,i386 |
sid | 5.2.3-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
experimental | 7.0.0-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster | 4.2.3-3 | amd64,arm64,armhf,i386 |
Debtags of package libxc-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
|
LibXC is a library of exchange-correlation (XC) functionals for
density-functional theory (DFT). The aim is to provide a portable, well
tested and reliable set of exchange and correlation functionals that
can be used by other codes.
This package contains the static library, the C headers and the Fortran
modules necessary for developers.
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netcdf-doc
documentation pour NetCDF
|
Versions of package netcdf-doc |
Release | Version | Architectures |
buster | 4.6.2-1 | all |
stretch | 4.4.1.1-2 | all |
bullseye | 4.7.4-1 | all |
jessie | 4.1.3-7.2 | all |
bookworm | 4.9.0-3 | all |
trixie | 4.9.2-7 | all |
sid | 4.9.2-7 | all |
experimental | 4.9.3~rc2-1~exp1 | all |
upstream | 4.9.3~rc2 |
Debtags of package netcdf-doc: |
made-of | html, info, postscript |
role | documentation |
|
License: DFSG free
|
NetCDF (network Common Data Form, « formulaire de données communes en réseau »)
est une interface pour l'accès aux données scientifiques et une bibliothèque
logicielle librement distribuée qui met en œuvre l'interface. La bibliothèque
NetCDF définit aussi un format indépendant de la machine pour représenter des
données scientifiques. Ensemble, l'interface, la bibliothèque et le format
gèrent la création, l'accès et le partage de données scientifiques.
Ce paquet fournit la documentation pour la bibliothèque de NetCDF dans divers
formats.
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pyfai
Fast Azimuthal Integration scripts
|
Versions of package pyfai |
Release | Version | Architectures |
stretch-backports | 0.15.0+dfsg1-1~bpo9+1 | all |
bookworm | 0.21.3+dfsg1-4 | all |
bullseye | 0.20.0+dfsg1-3 | all |
buster-backports | 0.19.0+dfsg1-3~bpo10+1 | all |
buster | 0.17.0+dfsg1-3 | all |
stretch | 0.13.0+dfsg-1 | all |
jessie | 0.10.2-1 | amd64,armel,armhf,i386 |
bookworm-backports | 2023.9.0-1~bpo12+1 | all |
trixie | 2024.05-3 | all |
sid | 2024.05-3 | all |
experimental | 2024.09-1 | all |
upstream | 2024.09 |
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License: DFSG free
|
PyFAI is a Python library for azimuthal integration; it allows the conversion
of diffraction images taken with 2D detectors like CCD cameras into X-Ray
powder patterns that can be used by other software like Rietveld refinement
tools (i.e. FullProf), phase analysis or texture analysis.
As PyFAI is a library, its main goal is to be integrated in other tools like
PyMca, LiMa or EDNA. To perform online data analysis, the precise description
of the experimental setup has to be known. This is the reason why PyFAI
includes geometry optimization code working on "powder rings" of reference
samples. Alternatively, PyFAI can also import geometries fitted with other
tools like Fit2D.
PyFAI has been designed to work with any kind of detector with any geometry
(transmission, reflection, off-axis, ...). It uses the Python library FabIO
to read most images taken by diffractometer.
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python3-binoculars
Surface X-ray diffraction 2D detector data reduction - Python3
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Versions of package python3-binoculars |
Release | Version | Architectures |
buster | 0.0.4-1 | all |
bookworm | 0.0.13-1 | all |
trixie | 0.0.19-1 | all |
bullseye | 0.0.6-1 | all |
sid | 0.0.19-1 | all |
bookworm-backports | 0.0.19-1~bpo12+1 | all |
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License: DFSG free
|
BINoculars is a tool for data reduction and analysis of large sets of
surface diffraction data that have been acquired with a
two-dimensional X-ray detector. The intensity of each pixel of a
two-dimensional detector is projected onto a three-dimensional grid
in reciprocal-lattice coordinates using a binning algorithm. This
allows for fast acquisition and processing of high-resolution data
sets and results in a significant reduction of the size of the data
set. The subsequent analysis then proceeds in reciprocal space. It
has evolved from the specific needs of the ID03 beamline at the ESRF,
but it has a modular design and can be easily adjusted and extended
to work with data from other beamlines or from other measurement
techniques.
This is the Python 3 version of the package.
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python3-cctbx
boite à outils en Python pour la cristallographie
|
Versions of package python3-cctbx |
Release | Version | Architectures |
bookworm | 2022.9+ds2+~3.11.2+ds1-6 | amd64,arm64,ppc64el,s390x |
sid | 2024.10+ds2+~3.22.1+ds1-4 | amd64,arm64,ppc64el,riscv64,s390x |
trixie | 2024.10+ds2+~3.22.1+ds1-4 | amd64,arm64,ppc64el,riscv64,s390x |
upstream | 2024.11+~3.22.1 |
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License: DFSG free
|
Il s’agit d’une boîte à outils logicielle pour la cristallographie qui
fournit les modules suivants :
– annlib_adaptbx,
– boost_adaptbx,
– cbflib_adaptbx,
– ccp4io_adaptbx :enveloppes pour la fonctionnalité Boost dans CCTBX ;
– cctbx : bibliothèques pour les applications de cristallographie,
utiles pour la cristallographie de petites molécules et
macro-molécules ;
– cma_es,
– crys3d : modules d’affichage de molécules, de densité d’électrons,
et de données de réseau réciproque ;
– dxtbx : la boîte à outils d’image de diffraction pour la gestion de
détecteur de rayons X de complexité arbitraire pour
différents formats standard ;
– fable : bibliothèque d’émulation Fortran pour porter Fortran77 vers C++ ;
– gltbx : liaisons de Python pour OpenGL ;
– iotbx : travailler avec les formats courants de fichier de
cristallographie ;
– libtbx : le système de construction commun à tous les autres modules.
Cela inclut une très fine enveloppe autour de l’outil
logiciel de construction SCons. Il fournit aussi des
utilitaires et des cadriciels utiles pour simplifier le
développement d’application, incluant des outils de
régression de test, la parallélisation à travers des systèmes
multiprocesseurs et grappes et une syntaxe de configuration
modulaire appelée PHIL (Python Hierarchial Interface Language)
utilisée pour tout le CCTBX ;
– mmtbx : fonctionnalité spécifique à la cristallographie de
macro-molécules. Cela comprend toute la machinerie nécessaire
pour le réglage des contraintes de géométrie, la correction
et la mise à l’échelle de milieu ambiant, l’analyse de
données de diffraction macro-moléculaire, le calcul de
coefficients de mappage pondérés et la plupart des méthodes
mises en œuvre dans phenix.refine. La majorité de
l’infrastructure pour le serveur de validation MolProbity
(et équivalent Phenix) est aussi située ici ;
– omptbx : interface OpenMP ;
– rstbx : boîte à outils de réseau réciproque pour autoindexer la
diffraction de petites molécules Bragg, les vecteurs de
de réseau réciproque indiqués ;
– scitbx : calculs généraux scientifiques, incluant une famille de
types de tableau C++ de haut niveau, une bibliothèque de
transformée de Fourier rapide et un portage en C++ du
minimiseur populaire L-BFGS quasi-Newton ;
– smtbx : cristallographie de petites molécules ;
– spotfinder :
– tbxx :
– wxtbx : contrôles wxPython utilisés dans l’interface graphique Phenix
et utilitaires divers.
Ce paquet fournit une collection sélective de modules python du projet cctbx.
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python3-cif2cell
prepare CIF files for electronic structure calculations
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Versions of package python3-cif2cell |
Release | Version | Architectures |
bookworm | 2.0.0a5+dfsg-1 | all |
sid | 2.1.0+dfsg-1 | all |
trixie | 2.1.0+dfsg-1 | all |
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License: DFSG free
|
cif2cell is a tool to generate the geometrical setup for various electronic
structure codes from a CIF (Crystallographic Information Framework) file. The
code will generate the crystal structure for the primitive cell or the
conventional cell.
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python3-fabio
bibliothèque d'E/S pour les images produites par détecteurs de rayons⋅X en⋅2D –⋅Python⋅3
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Versions of package python3-fabio |
Release | Version | Architectures |
buster | 0.8.0+dfsg-1 | amd64,arm64,armhf,i386 |
buster-backports | 0.10.0+dfsg-1~bpo10+1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bullseye | 0.11.0+dfsg-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 0.14.0+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm-backports | 2023.6.0-3~bpo12+1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el |
trixie | 2024.4.0-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64 |
sid | 2024.4.0-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64 |
stretch | 0.4.0+dfsg-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
stretch-backports | 0.7.0+dfsg-2~bpo9+1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
upstream | 2024.9.0 |
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License: DFSG free
|
FabIO est une bibliothèque d’E/S pour les images produites par des
détecteurs de rayons X en 2D et écrite en Python. FabIO prend en charge les
détecteurs d'image issus d'une douzaine d'entreprises (notamment Mar,
Dectris, ADSC, Hamamatsu, Oxford…), soit un total de 20 formats de fichier
différents (comme CBF, EDF, TIFF…), et il offre une interface uniforme pour
leurs entêtes (comme un dictionnaire Python) et leurs jeux de données (comme
une structure ndarray d'entiers ou de flottants de NumPy).
Il s'agit de la version Python⋅3 du paquet.
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python3-gpyfft
enveloppe pour la bibliothèque FFT OpenCL, clFFT – Python 3
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Versions of package python3-gpyfft |
Release | Version | Architectures |
buster | 0.7.0-1 | amd64,arm64,armhf,i386 |
sid | 0.7.1-2 | amd64,arm64,armel,armhf,i386 |
bullseye | 0.7.0-2 | amd64,arm64,armel,armhf,i386 |
stretch-backports | 0.7.0-1~bpo9+1 | amd64,arm64,armhf,i386 |
bookworm | 0.7.1-2 | amd64,arm64,armel,armhf,i386 |
trixie | 0.7.1-2 | amd64,arm64,armel,armhf,i386 |
upstream | 0.8.0 |
|
License: DFSG free
|
Cette enveloppe de Python est conçue pour s’intégrer étroitement avec
PyOpenCL. Elle consiste en une enveloppe de bas niveau basée sur Cython avec
une interface similaire à la bibliothèque C sous-jacente. Et par-dessus
tout, elle propose une interface de haut niveau conçue pour travailler sur
des données contenues dans des instances de pyopencl.array.Array, une classe
de tableau fonctionnant comme numpy pour des calculs de GPU. L’interface de
haut niveau s’inspire quelque peu de pyFFTW. Pour des détails sur
l’interface de haut niveau, consulter fft.py.
Ce paquet installe la bibliothèque pour Python 3.
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python3-nxs
format NeXus de fichiers de données scientifiques – liaisons de Python 3
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Versions of package python3-nxs |
Release | Version | Architectures |
trixie | 4.4.1-6 | all |
sid | 4.4.1-6 | all |
bookworm | 4.4.1-4 | all |
bullseye | 4.4.1-3 | all |
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License: DFSG free
|
NeXus est un format de données courant pour la science des rayons X, des
neutrons et des muons. Il a été développé comme norme internationale par
les scientifiques et les programmeurs des institutions scientifiques
majeures d’Europe, d’Asie, d’Australie et d’Amérique du Nord dans le but
d’améliorer la coopération pour l’analyse et la visualisation de données
de neutrons, de rayons X et de muons.
Ce paquet fournit les liaisons de Python 3.
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python3-periodictable
Extensible periodic table of the elements (Python 3)
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Versions of package python3-periodictable |
Release | Version | Architectures |
trixie | 2.0.1-1 | all |
buster | 1.5.0-7 | all |
bookworm | 1.6.0-1 | all |
bullseye | 1.5.3-1 | all |
sid | 2.0.1-1 | all |
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License: DFSG free
|
This package provides a periodic table of the elements with support
for mass, density and xray/neutron scattering information.
Masses, densities and natural abundances come from the NIST Physics
Laboratory, but do not represent a critical evaluation by NIST
scientists.
Neutron scattering calculations use values collected by the Atomic
Institute of the Austrian Universities. These values do corresponding
to those from other packages, though there are some differences
depending to the tables used. Bound coherent neutron scattering for
gold in particular is significantly different from older value:
7.63(6) as measured in 1974 compared to 7.90(7) as measured in 1990.
X-ray scattering calculations use a combination of empirical and
theoretical values from the LBL Center for X-ray Optics. These values
differ from those given in other sources such as the International
Tables for Crystallography, Volume C, and so may give different
results from other packages.
This package installs the library for Python 3.
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python3-pycodcif
error-correcting CIF parser - Python3 bindings
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Versions of package python3-pycodcif |
Release | Version | Architectures |
bullseye | 3.1.0+dfsg-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 3.10.0+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
trixie | 3.10.0+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster | 2.3+dfsg-3 | amd64,arm64,armhf,i386 |
bookworm | 3.7.0+dfsg-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
|
Python bindings for Crystallographic Information Format (CIF) v1.1
and v2.0 parser, which is written in C language, and developed by the
Crystallography Open Database. A CIF format file is represented by a
list of data blocks, where each data block is represented by a
dictionary.
This package installs the library for Python 3.
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python3-pyfftw
Pythonic wrapper around FFTW - Python 3
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Versions of package python3-pyfftw |
Release | Version | Architectures |
bookworm | 0.13.0-2 | amd64,arm64,i386,mips64el,ppc64el,s390x |
sid | 0.13.1-2 | amd64,arm64,i386,mips64el,ppc64el,s390x |
bullseye | 0.12.0-1 | amd64,arm64,i386,mips64el,ppc64el,s390x |
buster | 0.11.1-2 | amd64,arm64,i386 |
jessie | 0.9.2+dfsg-2 | amd64,i386 |
upstream | 0.15.0 |
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License: DFSG free
|
Pythonic wrapper around FFTW, the speedy FFT library. The ultimate
aim is to present a unified interface for all the possible transforms
that FFTW can perform.
Both the complex DFT and the real DFT are supported, as well as
arbitrary axes of abitrary shaped and strided arrays, which makes it
almost feature equivalent to standard and real FFT functions of
numpy.fft (indeed, it supports the clongdouble dtype which numpy.fft
does not).
pyFFTW is BSD-licensed and should not be confused with python-fftw, a
GPL-licensed python module with the same aim of providing python
bindings to FFTW3. Or python3-gpyfft, which provides bindings to the
OpenCL FFT library clFFT.
This package provides the Python 3 bindings.
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python3-qutip
paquet de Python pour la simulation de la dynamique des systèmes quantiques ouverts
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Versions of package python3-qutip |
Release | Version | Architectures |
bookworm | 4.7.1-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 5.0.3-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bullseye | 4.5.3-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 5.0.3-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
upstream | 5.0.4 |
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License: DFSG free
|
QuTiP est logiciel au code source ouvert pour simuler des systèmes
quantiques ouverts. La bibliothèque QuTiP dépend des paquets de calcul
excellents Numpy, Scipy et Cython. De plus, une sortie graphique est
fournie par Matplotlib. QuTiP vise à fournir des simulations numériques
efficaces et conviviales d’une grande diversité d’hamiltoniens, incluant
ceux avec une dépendance temporelle arbitraire couramment trouvés dans une
large tranche d’applications physiques, telles que l’optique quantique,
les pièges à ions, les circuits supraconducteurs et les résonateurs
quantiques nanométriques.
Ce paquet installe la bibliothèque pour Python 3.
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python3-sasdata
Data file handling for small-angle scattering (Python 3)
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Versions of package python3-sasdata |
Release | Version | Architectures |
bookworm | 0.8.1-3 | all |
experimental | 0.9.0-1 | all |
sid | 0.8.1-5 | all |
trixie | 0.8.1-5 | all |
upstream | 0.9.0 |
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License: DFSG free
|
The sasdata Python module provides utilities for importing and operating
on reduced small angle scattering data. The module may be used in standalone
code to build custom fitters, in conjunction with the sasmodels modules to
analyse data from custom scripts, or as part of the sasview analysis package.
This package contains the Python 3 module.
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python3-sasmodels
Theoretical models for small angle scattering (Python 3)
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Versions of package python3-sasmodels |
Release | Version | Architectures |
bookworm | 1.0.6-2 | all |
bullseye | 1.0.4-3 | all |
experimental | 1.0.8-1 | all |
trixie | 1.0.7-1 | all |
buster | 0.99-2 | all |
sid | 1.0.7-1 | all |
upstream | 1.0.8 |
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License: DFSG free
|
sasmodels is a Python module for calculating theoretical Small Angle
Scattering patterns. The models provided are usable directly in the bumps
fitting package and in the sasview analysis package.
This package contains the Python 3 version of the module.
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r-cran-rnetcdf
GNU R package that provides an R interface to NetCDF datasets
|
Versions of package r-cran-rnetcdf |
Release | Version | Architectures |
buster | 1.9-1-2 | amd64,arm64,armhf,i386 |
sid | 2.9-1-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
bookworm | 2.6-2-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
stretch | 1.8-2-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bullseye | 2.4-2-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
jessie | 1.6.3-1-1 | amd64,armel,armhf,i386 |
trixie | 2.9-1-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
upstream | 2.9-2 |
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License: DFSG free
|
This package provides an R interface to Unidata's NetCDF library
functions. NetCDF (network Common Data Form) is a set of interfaces
for array-oriented data access. In addition to the interface to the
NetCDF library functions, R interfaces are provided to access
Unidata's UDUNITS calendar conversions.
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root-system
??? missing short description for package root-system :-(
|
Versions of package root-system |
Release | Version | Architectures |
jessie | 5.34.19+dfsg-1.2 | all |
Debtags of package root-system: |
field | physics |
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License: DFSG free
|
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scalapack-doc
Scalable Linear Algebra Package Documentation
|
Versions of package scalapack-doc |
Release | Version | Architectures |
jessie | 1.5-10 | all |
bullseye | 1.5-11 | all |
stretch | 1.5-11 | all |
buster | 1.5-11 | all |
Debtags of package scalapack-doc: |
admin | cluster |
field | mathematics |
made-of | html, man, postscript |
role | documentation |
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License: DFSG free
|
ScaLAPACK is the parallel version of LAPACK. It depends on PVM or MPI.
This package provides the man pages for the routines in the
ScaLAPACK library (see package scalapack1-pvm, scalapack1-mpich or
scalapack1-lam) and a quick reference for PBLAS and ScaLAPACK. PBLAS
is the library for Parallel Basic Linear Algebra Subprograms included in
ScaLAPACK.
Also included: ScaLAPACK Users' Guide (SLUG) and the FAQ on ScaLAPACK.
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science-mathematics-dev
Debian Science Mathematics-dev packages
|
Versions of package science-mathematics-dev |
Release | Version | Architectures |
stretch | 1.7 | all |
jessie | 1.4 | all |
buster | 1.10 | all |
trixie | 1.14.7 | all |
sid | 1.14.7 | all |
bullseye | 1.14.2 | all |
bookworm | 1.14.5 | all |
Debtags of package science-mathematics-dev: |
field | mathematics |
role | metapackage |
suite | debian |
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License: DFSG free
|
This metapackage will install Debian Science packages which might be
helpful for development of applications for Mathematics.
You might also be interested in the science-mathematics metapackage.
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ufo-filters
Set of plugins for ufo-core - runtime
|
Versions of package ufo-filters |
Release | Version | Architectures |
trixie | 0.16.0.159.g483ce16-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
stretch | 0.13.0+dfsg1-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 0.14.1+dfsg1-2 | amd64,arm64,armhf,i386 |
bullseye | 0.16.0.159.g483ce16-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 0.16.0.159.g483ce16-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
sid | 0.16.0.159.g483ce16-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
upstream | 0.16.0.172.g6f43afc |
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License: DFSG free
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The UFO data processing framework is a C library suited to build
general purpose streams data processing on heterogeneous
architectures such as CPUs, GPUs or clusters. It is extensively used
at the Karlsruhe Institute of Technology for Ultra-fast X-ray Imaging
(radiography, tomography and laminography).
This package contains average', backproject', bin', blur', buffer', calculate', camera', clip', contrast', crop', denoise', duplicate',
fftmult', fft', filter', flatten', flip', forwardproject', gemm', ifft', interpolate', loop', measure', merge', metaballs', monitor',
null', opencl', ordfilt', pad', read', reduce', refeed', replicate',
rescale', ringwriter', sleep', slice', stack', stdin', stdout', subtract', transpose', write' and `zeropad' plugins
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vecgeom-dev
geometry library for particle-detector simulation - development files
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Versions of package vecgeom-dev |
Release | Version | Architectures |
bookworm | 1.2.1+dfsg-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 1.2.8+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 1.2.8+dfsg-2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
upstream | 1.2.10 |
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License: DFSG free
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VecGeom is a vectorized geometry modeller library with hit-detection features
as needed by particle detector simulation at the LHC and beyond.
This package includes the development files for VecGeom.
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Official Debian packages with lower relevance
libfeel++-dev
??? missing short description for package libfeel++-dev :-(
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Versions of package libfeel++-dev |
Release | Version | Architectures |
jessie | 0.99.0-final.1-1 | amd64,i386 |
Debtags of package libfeel++-dev: |
devel | library |
role | devel-lib |
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License: DFSG free
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libfftw3-doc
documentation pour la version 3 de fftw
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Versions of package libfftw3-doc |
Release | Version | Architectures |
sid | 3.3.10-2 | all |
trixie | 3.3.10-2 | all |
bookworm | 3.3.10-1 | all |
bullseye | 3.3.8-2 | all |
buster | 3.3.8-2 | all |
stretch | 3.3.5-3 | all |
jessie | 3.3.4-2 | all |
Debtags of package libfftw3-doc: |
devel | doc |
field | mathematics |
made-of | html, info |
role | documentation |
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License: DFSG free
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La bibliothèque FFTW calcule les transformées de Fourier rapides (FFT) en
une ou plusieurs dimensions. Elle est très rapide. Ce paquet fournit la
documentation pour la bibliothèque fftw3.
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oce-draw
??? missing short description for package oce-draw :-(
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Versions of package oce-draw |
Release | Version | Architectures |
bookworm | 0.18.3-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
jessie | 0.15-5 | amd64,armel,armhf,i386 |
bullseye | 0.18.3-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
buster | 0.18.2-3 | amd64,arm64,armhf,i386 |
stretch | 0.17.2-2 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
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License: DFSG free
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python3-h5py
interface généraliste de Python pour hdf5
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Versions of package python3-h5py |
Release | Version | Architectures |
buster | 2.8.0-3 | amd64,arm64,armhf,i386 |
trixie | 3.12.1-1 | all |
jessie | 2.2.1-1.1 | amd64,armel,armhf,i386 |
bookworm | 3.7.0-8 | all |
sid | 3.12.1-1 | all |
stretch | 2.7.0-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
bullseye | 2.10.0-9 | all |
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License: DFSG free
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HDF5 pour Python (h5py) est une interface Python généraliste pour la
bibliothèque Hierarchical Data Format, version 5. HDF5 est une bibliothèque
polyvalente, scientifiquement mature, conçue pour un stockage rapide et flexible
d'énormes quantités de données.
Du point de vue d'un programmeur Python, HDF5 offre une manière robuste de
stocker des données, organisées par nom sous forme arborescente. Des bases de
données peuvent être créées (baies de stockage) de centaines de gigaoctets et
effectuer des accès E/S aléatoires dans les sections désirées. Les jeux de
données sont organisés dans une hiérarchie de type système de fichiers en
utilisant des conteneurs appelés « groupes », et auxquels l’accès se fait en
utilisant la syntaxe traditionnelle POSIX /chemin/vers/ressource.
H5py fournit une interface simple, robuste en lecture/écriture, pour les données
HDF5 à partir de Python. Les concepts existants de Python et Numpy sont utilisés
pour l'interface ; par exemple, les jeux de données sur le disque sont
représentés par une classe mandataire qui gère le transfert de sous-ensembles
(slicing) et qui possède les attributs dtype et shape. Les groupes HDF5 sont
présentés en utilisant la métaphore d'un dictionnaire, indexés par nom.
Ce paquet est un paquet simple de dépendance qui dépend de la construction série
ou MPI de h5py et fournit les fichiers de test de données.
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python3-netcdf4
interface de Python 3 pour la bibliothèque netCDF4 (network Common Data Form)
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Versions of package python3-netcdf4 |
Release | Version | Architectures |
bookworm | 1.6.2-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bullseye | 1.5.5.1-1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
stretch | 1.2.7-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 1.4.2-1 | amd64,arm64,armhf,i386 |
trixie | 1.7.2-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 1.7.2-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
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License: DFSG free
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La version 4 de NetCDF possède de nombreuses fonctions non trouvées dans
les précédentes versions de la bibliothèque et est implémentée au-dessus
de HDF5. Ce module peut lire et écrire à la fois dans le nouveau format
netCDF 4 et dans l’ancien netCDF 3, et il peut créer des fichiers lisibles
par les clients HDF5. L’interface de programmation applicative est conçue
selon le modèle de Scientific.IO.NetCDF, et devrait être familière aux
utilisateurs de ce module.
La plupart des nouvelles fonctions de netCDF 4 sont mises en œuvre, telles
que plusieurs dimensions illimitées, les groupes et la compression zlib
des données. Tous les nouveaux types numériques de données (tels que les
types d’entier 64 bits et non signé) sont implémentés. Les types de
données composite et à longueur variable (vlen) sont gérés, mais les types
de données énumération et opaque ne sont pas gérés. Les mélanges de types
composite et vlen (types composite contenant des types vlen et
inversement) ne sont pas gérés.
Ce paquet fournit le module netCDF 4 pour Python 3.
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python3-threadpoolctl
Python helpers for common threading libraries (BLAS, OpenMP)
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Versions of package python3-threadpoolctl |
Release | Version | Architectures |
bullseye | 2.1.0-1 | all |
bookworm | 3.1.0-1 | all |
trixie | 3.1.0-1 | all |
sid | 3.1.0-1 | all |
buster-backports | 2.1.0-1~bpo10+1 | all |
upstream | 3.5.0 |
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License: DFSG free
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Thread-pool Controls provides Python helpers to limit the number of threads
used in the threadpool-backed of common native libraries used for scientific
computing and data science (e.g. BLAS and OpenMP).
Fine control of the underlying thread-pool size can be useful in workloads
that involve nested parallelism so as to mitigate oversubscription issues.
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Debian packages in contrib or non-free
gsl-doc-info
GNU Scientific Library (GSL) Reference Manual in info
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Versions of package gsl-doc-info |
Release | Version | Architectures |
stretch | 1.16-1 (non-free) | all |
buster | 2.3-1 (non-free) | all |
bookworm | 2.7.1-1 (non-free) | all |
trixie | 2.7.1-1 (non-free) | all |
jessie | 1.16-1 (non-free) | all |
bullseye | 2.6-1 (non-free) | all |
sid | 2.7.1-1 (non-free) | all |
upstream | 2.8 |
Debtags of package gsl-doc-info: |
devel | doc, lang:c |
field | mathematics |
made-of | info |
role | documentation |
suite | gnu |
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License: non-free
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This package provides info files with the reference manual for the
GNU Scientific Library (GSL), a collection of routines for numerical
analysis.
The reference manual is also available in postscript and html formats
in the packages gsl-ref-psdoc and gsl-ref-html, respectively.
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gsl-doc-pdf
GNU Scientific Library (GSL) Reference Manual in pdf
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Versions of package gsl-doc-pdf |
Release | Version | Architectures |
trixie | 2.7.1-1 (non-free) | all |
jessie | 1.16-1 (non-free) | all |
buster | 2.3-1 (non-free) | all |
bookworm | 2.7.1-1 (non-free) | all |
bullseye | 2.6-1 (non-free) | all |
sid | 2.7.1-1 (non-free) | all |
stretch | 1.16-1 (non-free) | all |
upstream | 2.8 |
Debtags of package gsl-doc-pdf: |
devel | doc, lang:c |
field | mathematics |
made-of | pdf |
role | documentation |
suite | gnu |
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License: non-free
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This package provides a pdf file with the reference manual for the
GNU Scientific Library (GSL), a collection of routines for numerical
analysis.
The reference manual is also available in postscript and html formats
in the packages gsl-ref-psdoc and gsl-ref-html, respectively.
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gsl-ref-html
GNU Scientific Library (GSL) Reference Manual in html
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Versions of package gsl-ref-html |
Release | Version | Architectures |
sid | 2.3-1 (non-free) | all |
stretch | 1.16-1 (non-free) | all |
bullseye | 2.3-1 (non-free) | all |
bookworm | 2.3-1 (non-free) | all |
buster | 2.3-1 (non-free) | all |
trixie | 2.3-1 (non-free) | all |
jessie | 1.16-1 (non-free) | all |
Debtags of package gsl-ref-html: |
devel | doc, lang:c |
field | mathematics |
made-of | html |
role | documentation |
suite | gnu |
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License: non-free
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This package provides html files with the reference manual for the
GNU Scientific Library (GSL), a collection of routines for numerical
analysis.
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gsl-ref-psdoc
GNU Scientific Library (GSL) Reference Manual in postscript
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Versions of package gsl-ref-psdoc |
Release | Version | Architectures |
buster | 2.3-1 (non-free) | all |
sid | 2.3-1 (non-free) | all |
trixie | 2.3-1 (non-free) | all |
bullseye | 2.3-1 (non-free) | all |
stretch | 1.16-1 (non-free) | all |
jessie | 1.16-1 (non-free) | all |
bookworm | 2.3-1 (non-free) | all |
Debtags of package gsl-ref-psdoc: |
devel | doc, lang:c |
field | mathematics |
made-of | postscript |
role | documentation |
suite | gnu |
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License: non-free
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This package provides a ps file with the reference manual for the
GNU Scientific Library (GSL), a collection of routines for numerical
analysis.
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Packaging has started and developers might try the packaging code in VCS
libcblas-dev
Basic Linear Algebra Subroutines 3, static library
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Versions of package libcblas-dev |
Release | Version | Architectures |
VCS | 3.2.1+dfsg-1 | all |
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License: BSD-3-clause
Debian package not available
Version: 3.2.1+dfsg-1
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This package is a binary incompatible upgrade to the blas-dev
package. Several minor changes to the C interface have been
incorporated.
BLAS (Basic Linear Algebra Subroutines) is a set of efficient
routines for most of the basic vector and matrix operations.
They are widely used as the basis for other high quality linear
algebra software, for example lapack and linpack. This
implementation is the Fortran 77 reference implementation found
at netlib.
This implementation of the library belongs to the CLAPACK distribution.
This package contains a static version of the library.
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No known packages available
libpspio-dev
Library to read and write pseudopotentials
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License: LGPL
Debian package not available
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Pseudopotentials consist in atomic data used for atomic-scale electronic
structure calculations. Libpspio is a library to read and write
pseudopotentials in various formats, allowing as well for conversion in
some cases.
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wannier90-1-dev
Maximally Localized Wannier Functions - Development files
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License: GPL
Debian package not available
Language: Fortran 90
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Wannier90 is an electronic-structure software computing
maximally-localized Wannier functions (MLWF). It works on top of other
electronic-structure software, such as Abinit, FLEUR, and PwSCF.
This package contains the development files needed to interface other
software with Wannier90.
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