Theoretical and Computational Chemistry
PhD candidate
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University of Bergen
- Norway
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LuisFCervantes/ff14SB_CHARMM
LuisFCervantes/ff14SB_CHARMM PublicTopology and parameter files necessary to run the AMBER ff14SB protein force field in CHARMM.
Rich Text Format 1
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reuter-group/bayer_compounds_msld
reuter-group/bayer_compounds_msld PublicRelative binding free energy via MSLD for HNE and PR3.
Python
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