choderalab / openmoltools

An open set of tools for automating tasks relating to small molecules
MIT License
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Migration of forcefield_generators.py to openmm-forcefields #256

Open jchodera opened 7 years ago

jchodera commented 7 years ago

We are planning to migrate (and refactor) forcefield_generators.py to http://github.com/choderalab/openmm-forcefields, which will also provide the latest OpenMM and CHARMM forcefields in OpenMM native ffxml format.

The current openmoltools.forcefield_generators will be deprecated. I'll add a warning to the existing code that this functionality will be removed in a future release.