Last released Mar 8, 2018
Python script to provide BOSS generated OPLS-AA/CM1A(-LBCC) parameters for organic molecules and ligands.
Last released Dec 4, 2017
Python script to chop proteins and prepare z-matrices needed for MCPRO simulations.
Last released Sep 7, 2017
A package to automatically fix chain breaks in PDB files using MODELLER
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