Molecular modeling of organic and biomolecular systems using BOSS and MCPRO

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. © 2005 Wiley Periodicals, Inc. J Comput Chem 26: 1689–1700, 2005