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Published 20 hours ago • verified publisher icon openforcefield

Migrate Roche fragment set torsion drive input scripts here

Open jchodera opened this issue 5 years ago • 1 comments

We should migrate the Roche fragment set torsion drive input scripts here from wherever they are.

jchodera avatar Jul 04 '19 15:07 jchodera

Also we should put in a PDF of the Roche molecules at the same time.

davidlmobley avatar Aug 29 '19 22:08 davidlmobley