TY - JOUR AU - Brooks, B. R. AU - Bruccoleri, R. E. AU - Olafson, D. J. AU - States, D. J. AU - Swaminathan, S. AU - Karplus, M. PY - 1983// TI - CHARMM: A Program for Macromolecular Energy, Minimization, and Dynamics Calculations JO - Journal of Computational Chemistry SP - 187 EP - 217 VL - 4 ID - CHARMM1983 ER - TY - CHAP AU - MacKerel Jr. , A. D. AU - Brooks III, C. L. AU - Nilsson, L. AU - Roux, B. AU - Won, Y. AU - Karplus, M. ED - P, v. R. Schleyer et al. PY - 1998// BT - CHARMM: The Energy Function and Its Parameterization with an Overview of the Program T3 - The Encyclopedia of Computational Chemistry SP - 271 EP - 277 VL - 1 PB - John Wiley & Sons: Chichester ID - CHARMMFF ER -