Topology and parameters for small organic molecules compatible with the CHARMM all atoms force field, for use with CHARMM and GROMACS
SwissParam is a webserver that provides topology and parameters for small organic molecules. These parameters are intended for drug design type calculations, such as docking, minimizations, rapid binding energy estimation (LIECE), etc.
V. Zoete, M. A. Cuendet, A. Grosdidier, O. Michielin, SwissParam, a Fast Force Field Generation Tool For Small Organic Molecules, J. Comput. Chem, 2011, 32(11), 2359-68. PMID: 21541964, DOI: 10.1002/jcc.21816.
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