Molecular modeling of organic and biomolecular systems using BOSS and MCPRO
Top Cited Papers
- 30 September 2005
- journal article
- review article
- Published by Wiley in Journal of Computational Chemistry
- Vol. 26 (16), 1689-1700
- https://doi.org/10.1002/jcc.20297
Abstract
An overview is provided of the capabilities for the current versions of the BOSS and MCPRO programs for molecular modeling of organic and biomolecular systems. Recent applications are noted, particularly for QM/MM studies of organic and enzymatic reactions and for protein-ligand binding.Keywords
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