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simtk.openmm.app.charmmparameterset Namespace Reference

Classes

class  CharmmParameterSet
 Stores a parameter set defined by CHARMM files. More...
 

Detailed Description

This module contains classes for parsing and processing CHARMM parameter,

topology, and stream files. It only extracts atom properties from the

topology files and extracts all parameters from the parameter files



This file is part of the OpenMM molecular simulation toolkit originating from

Simbios, the NIH National Center for Physics-Based Simulation of Biological

Structures at Stanford, funded under the NIH Roadmap for Medical Research,

grant U54 GM072970. See https://simtk.org.  This code was originally part of

the ParmEd program and was ported for use with OpenMM.



Copyright (c) 2014 the Authors



Author: Jason M. Swails

Contributors:

Date: Sep. 17, 2014



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