Authors:
Halgren, TA
Roberts, JD
Horner, JH
Martinez, FN
Tronche, C
Newcombe, M
Citation: Ta. Halgren et al., Kinetics and equilibrium constants for reactions of alpha-phenyl-substituted cyclopropylcarbinyl radicals, J AM CHEM S, 122(13), 2000, pp. 2988-2994
Citation: Ta. Halgren, MMFF VII. Characterization of MMFF94, MMFF94s, and other widely available force fields for conformational energies and for intermolecular-interactionenergies and geometries, J COMPUT CH, 20(7), 1999, pp. 730-748
Citation: Bl. Bush et al., Consensus bond-charge increments fitted to electrostatic potential or field of many compounds: Application to MMFF94 training set, J COMPUT CH, 20(14), 1999, pp. 1495-1516