Decisions in force field development: an alternative to those described by Roterman et al. (J. Biomol. Struct. Dyn. 7, 421 (1989)).
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.
Kollman
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PA
Department of Pharmaceutical Chemistry, University of California, San Francisco 94143.
Dill
K A
KA
D003198:Computer Simulation; D004151:Dipeptides / Q000737:chemistry*; D010455:Peptides; D011487:Protein Conformation
D004151:Dipeptides; D010455:Peptides; C019529:polyalanine; C002956:alanylalanine