GitHub topics: molecule-builder
mosdef-hub/mbuild
A hierarchical, component based molecule builder
Language: Python - Size: 74.7 MB - Last synced at: about 4 hours ago - Pushed at: about 5 hours ago - Stars: 192 - Forks: 82
qcscine/molassembler
Chemoinformatics toolkit with support for inorganic molecules
Language: C++ - Size: 10.3 MB - Last synced at: 29 days ago - Pushed at: 8 months ago - Stars: 35 - Forks: 7
jewettaij/moltemplate
A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
Language: Python - Size: 20 MB - Last synced at: 9 months ago - Pushed at: 9 months ago - Stars: 248 - Forks: 97
lukasturcani/vabene
Make valid molecular graphs!
Language: Python - Size: 71.3 KB - Last synced at: 9 days ago - Pushed at: about 1 year ago - Stars: 22 - Forks: 4
jewettaij/emoltemplate
A general cross-platform text-based molecule builder for ESPResSo similar to moltemplate
Size: 2.06 MB - Last synced at: over 1 year ago - Pushed at: about 5 years ago - Stars: 1 - Forks: 0