choderalab / openmoltools

An open set of tools for automating tasks relating to small molecules
MIT License
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Fix forcefield generators to work with latest ParmEd #275

Open jchodera opened 6 years ago

jchodera commented 6 years ago

Addresses https://github.com/ParmEd/ParmEd/issues/977

Note that this also requires https://github.com/ParmEd/ParmEd/pull/978

jchodera commented 6 years ago

Agreed! We should also pin to the latest ParmEd after it is released and add a check in this method to ensure a recent version of ParmEd is installed.