Chemical toolbox
https://github.com/openbabel/openbabel
License: GPL-2.0-only
Formula JSON API: /api/formula/open-babel.json
Formula code: open-babel.rb
on GitHub
Bottle (binary package) installation support provided for:
Apple Silicon | sequoia | ✅ |
---|---|---|
sonoma | ✅ | |
ventura | ✅ | |
Intel | sonoma | ✅ |
ventura | ✅ | |
64-bit linux | ✅ |
Current versions:
stable | ✅ | 3.1.1 |
head | ⚡️ | HEAD |
Revision: 2
Depends on:
cairo | 1.18.2 | Vector graphics library with cross-device output support |
eigen | 3.4.0 | C++ template library for linear algebra |
inchi | 1.07.1 | IUPAC International Chemical Identifier |
python@3.13 | 3.13.0 | Interpreted, interactive, object-oriented programming language |
Depends on when building from source:
cmake | 3.31.0 | Cross-platform make |
pkg-config | 0.29.2 | Manage compile and link flags for libraries |
rapidjson | 1.1.0 | JSON parser/generator for C++ with SAX and DOM style APIs |
swig | 4.3.0 | Generate scripting interfaces to C/C++ code |
Conflicts with: surelog
Analytics:
Installs (30 days) | |
---|---|
open-babel |
140 |
Installs on Request (30 days) | |
open-babel |
139 |
Build Errors (30 days) | |
open-babel |
0 |
Installs (90 days) | |
open-babel |
437 |
open-babel --HEAD |
1 |
Installs on Request (90 days) | |
open-babel |
434 |
open-babel --HEAD |
1 |
Installs (365 days) | |
open-babel |
1,723 |
open-babel --HEAD |
3 |
Installs on Request (365 days) | |
open-babel |
1,714 |
open-babel --HEAD |
3 |