Determination of side-chain-rotamer and side-chain and backbone virtual-bond-stretching potentials of mean force from AM1 energy surfaces of terminally-blocked amino-acid residues, for coarse-grained simulations of protein structure and folding. I. The method. - Urszula Kozlowska; Adam Liwo; Harold A. Scheraga (J. Comput. Chem., 2010)

Determination of side-chain-rotamer and side-chain and backbone virtual-bond-stretching potentials of mean force from AM1 energy surfaces of terminally-blocked amino-acid residues, for coarse-grained simulations of protein structure and folding. II. Results, comparison with statistical potentials, and implementation in the UNRES force field. - Urszula Kozlowska; Gia G. Maisuradze; Adam Liwo; Harold A. Scheraga (J. Comput. Chem., 2010)