The following software repositories are developed in Open Force Field Consortium research groups. Projects closer to “production-ready” status in the Consortium’s force field optimization are nearer to the top of the page, while those that are more exploratory are near the bottom.
Active in force field optimization
Name | Travis | CodeCov | Documentation | LGTM |
---|---|---|---|---|
ForceBalance | doxygen | |||
GeomeTRIC | GH Readme | |||
Open Force Field Toolkit | ||||
Paprika | ||||
OpenFF Evaluator | ||||
QCFractal | ||||
smirnoff99Frosst | README | |||
TorsionDrive |
Potential additions to force field optimization or bespoke workflow
Name | Travis | CodeCov | Documentation | LGTM |
---|---|---|---|---|
CMILES | ||||
Fragmenter |
Supporting, long-term, and exploratory software
Name | Travis | CodeCov | Documentation | LGTM |
---|---|---|---|---|
Chemper | ||||
OFF_Nitrogens | No | |||
Quanformer | ||||
RESPPOL | ||||
Respyte | GH Readme |