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John Chodera d2070b2cbf Merge pull request #68 from choderalab/phosaa10 
Add missing phosaa10.xml file
2018-09-11 14:44:42 -04:00
amber
Add missing phosaa10.xml
2018-09-11 14:44:06 -04:00
charmm
Add DISU patch and add tests for CHARMM
2018-08-18 13:49:27 -04:00
devtools
In process of updating to AmberTools 18 [incomplete]
2018-08-19 13:47:13 -07:00
openmmforcefields
Add __init__.py
2017-06-23 23:30:11 -04:00
.travis.yml
Update paths for travis
2018-08-24 17:58:43 -07:00
LICENSE
Add travis boilerplate
2017-04-17 13:48:10 -04:00
README.md
Update README
2017-10-20 18:38:46 -04:00
setup.py
Add ambertools dependency; remove build-time dependencies
2017-09-29 17:26:10 -04:00

README.md

Build Status DOI

CHARMM and AMBER forcefields for OpenMM

Conversion tools for and repository of CHARMM and AMBER forcefields for OpenMM.

Manifest

  • charmm/ - CHARMM forcefield conversion tools
  • amber/ - AMBER forcefield conversion tools
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Readme MIT 83 MiB
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