Summary
Chemical Formula/Structure Editors
DebiChem chemical formular/structure editors
This metapackage will install drawers for chemical structures which might be
useful for chemists.
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 DebiChem
to you, or if you have prepared an unofficial Debian package, please do not hesitate to
send a description of that project to the DebiChem mailing list
Links to other tasks
|
DebiChem Chemical Formula/Structure Editors packages
Official Debian packages with high relevance
bkchem
Editor für chemische Strukturen
|
Versions of package bkchem |
Release | Version | Architectures |
sid | 0.14.0~pre4+git20211228-4 | all |
jessie | 0.13.0-4 | all |
stretch | 0.13.0-5 | all |
buster | 0.13.0-6 | all |
bookworm | 0.14.0~pre4+git20211228-3 | all |
trixie | 0.14.0~pre4+git20211228-4 | all |
Debtags of package bkchem: |
field | chemistry |
role | program |
|
License: DFSG free
|
BKchem ist ein freies Chemie-Zeichenprogramm, das in Python geschrieben
ist.
Einige Eigenschaften, die Sie erwarten können:
- Zeichnen (Zeichnen von Bindung zu Bindung; Vorlagen für gebräuchliche
Ringstrukturen; Expansion gebräuchlicher Gruppen; Zeichnen von
Radikalen, Ladungen, Pfeilen; Unterstützung von Farben ...)
- Bearbeiten (unbegrenztes Rückgängig machen und Wiederherstellen;
Ausrichten; Skalieren; Rotation (2D, 3D) ...)
- Export/Import (vollständige Unterstützung von SVG-,
OpenOffice.org-Draw-, EPS-Export; grundlegende Unterstützung von
CML1- und CML2-Im- und Export)
|
|
chemtool
chemical structures drawing program
|
Versions of package chemtool |
Release | Version | Architectures |
jessie | 1.6.14-1 | amd64,armel,armhf,i386 |
buster | 1.6.14-3 | amd64,arm64,armhf,i386 |
bullseye | 1.6.14-6 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 1.6.14-6 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 1.6.14-6 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 1.6.14-6 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
stretch | 1.6.14-1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
Debtags of package chemtool: |
field | chemistry |
interface | x11 |
role | program |
scope | application |
uitoolkit | gtk |
use | editing, learning |
works-with | image, image:vector |
works-with-format | svg |
x11 | application |
|
License: DFSG free
|
Chemtool is a GTK+ based 2D chemical structure editor for X11. It
supports many bond styles, most forms of text needed for chemical
typesetting and splines/arcs/curved arrows.
Drawings can be exported to MOL and PDB format, SVG or XFig format for
further annotation, as a PiCTeX drawing, as a bitmap or as Postscript
files (several of these through XFig's companion program fig2dev).
The package also contains a helper program, cht, to calculate sum
formula and (exact) molecular weight from a chemtool drawing file. Cht
can either be called directly by Chemtool or on the console.
|
|
easychem
Zeichnet hochqualitative Molekül- und zweidimensionale chemische Formeln
|
Versions of package easychem |
Release | Version | Architectures |
stretch | 0.6-8 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 0.6-8 | amd64,arm64,armhf,i386 |
bullseye | 0.6-9 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 0.6-9 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 0.6-9 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
jessie | 0.6-8 | amd64,armel,armhf,i386 |
sid | 0.6-9 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
Debtags of package easychem: |
field | chemistry |
interface | x11 |
role | program |
uitoolkit | gtk |
use | editing, learning, viewing |
x11 | application |
|
License: DFSG free
|
EasyChem ist ein Programm, welches Ihnen hilft, hochqualitative Diagramme von
Molekülen und zweidimensionale chemische Formeln zu erstellen, welche nach
PDF, PS, LaTeX und fig exportiert werden können.
EasyChem wurde ursprünglich entwickelt, um Diagramme für Chemiebücher zu
erstellen, und wird mittlerweile für kommerzielle und nichtkommerzielle
Chemiebücher eingesetzt.
|
|
gchempaint
Editor für chemische 2D-Strukturen für die GNOME2-Arbeitsfläche
|
Versions of package gchempaint |
Release | Version | Architectures |
sid | 0.14.17-6.2 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
jessie | 0.14.9-1 | amd64,armel,armhf,i386 |
stretch | 0.14.15-1+deb9u1 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
buster | 0.14.17-1.1 | amd64,arm64,armhf,i386 |
bullseye | 0.14.17-6 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 0.14.17-6.1 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
Debtags of package gchempaint: |
field | chemistry |
interface | x11 |
role | program |
suite | gnome |
uitoolkit | gtk |
use | editing, learning |
x11 | application |
|
License: DFSG free
|
GChemPaint ist ein Editor für chemische 2D-Strukturen mit einer
Schnittstelle für mehrere Dokumente. Gezeichnete Moleküle können im NIST
Webbook und in PubChem gesucht werden.
|
|
osra
optical structure recognition
|
Versions of package osra |
Release | Version | Architectures |
bookworm | 2.1.3-3 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
trixie | 2.1.3-3 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 2.1.3-3 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
|
License: DFSG free
|
OSRA is a utility designed to convert graphical representations of
chemical structures, as they appear in journal articles, patent documents,
textbooks, trade magazines etc., into SMILES (Simplified Molecular
Input Line Entry Specification) - a computer recognizable molecular structure
format. OSRA can read a document in any of the over 90 graphical formats
parseable by ImageMagick - including GIF, JPEG, PNG, TIFF, PDF, PS etc., and
generate the SMILES representation of the molecular structure images
encountered within that document.
|
|
xdrawchem
Chemical structures and reactions editor
|
Versions of package xdrawchem |
Release | Version | Architectures |
trixie | 1.11.1-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
sid | 1.11.1-1 | amd64,arm64,armel,armhf,i386,mips64el,ppc64el,riscv64,s390x |
buster | 1.10.2.1-2 | amd64,arm64,armhf,i386 |
stretch | 2.0-6 | amd64,arm64,armel,armhf,i386,mips,mips64el,mipsel,ppc64el,s390x |
jessie | 2.0-3 | amd64,armel,armhf,i386 |
bullseye | 1.11.0-2 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
bookworm | 1.11.0-4 | amd64,arm64,armel,armhf,i386,mips64el,mipsel,ppc64el,s390x |
Debtags of package xdrawchem: |
field | chemistry |
interface | x11 |
role | program |
uitoolkit | qt |
use | editing, learning, viewing |
x11 | application |
|
License: DFSG free
|
Xdrawchem is a 2D editor for chemical structures and reactions. It
mirrors the abilities of the commercial ChemDraw suite and has file
compatibility with it as well as other chemical formats through
OpenBabel.
This packaged version comes from a fork available at
https://gitlab.com/yamanq/xdrawchem, as the previous version was no
longer actively maintained. More information about it in the copyright
file.
|
|
|