title: Decisions in force field development: an alternative to those described by Roterman et al. (J. Biomol. Struct. Dyn. 7, 421 (1989)).
abstract: We attempt to give an alternate point of view of the analysis by Roterman et al. (J. Biolmol. Struct. Dyn. 7,415 (1989]. In particular, we argue for the use of flexible geometry and explicit inclusion of solvent effects in analyzing phi, psi maps of peptides.
authors.affiliation: Department of Pharmaceutical Chemistry, University of California, San Francisco 94143.
authors.forename: P A
authors.initials: PA
authors.lastname: Kollman
authors.forename: K A
authors.initials: KA
authors.lastname: Dill
mesh_terms: D003198:Computer Simulation; D004151:Dipeptides / Q000737:chemistry*; D010455:Peptides; D011487:Protein Conformation
chemical_list: D004151:Dipeptides; D010455:Peptides; C019529:polyalanine; C002956:alanylalanine