MacroModel

Versatile, full-featured program for molecular modeling

Below are selected publications from 2008; please check here to cite the use of MacroModel

  •   Guimarães, C. R. W.; Cardozo, M., "MM-GB/SA Rescoring of Docking Poses in Structure-Based Lead Optimization," J. Chem. Inf. Model., 2008, 48, 958–970
  •   Uccello-Barretta, G.; Balzano, F.; Bardoni, S.; Vanni, L.; Giuratob, L.; Guccione, S., "Chiral discrimination processes by C9 carbamate derivatives of dihydroquinine: interaction mechanisms of diastereoisomeric 9-O-[(S)- or (R)-1-(1-naphthyl)ethylcarbamate]dihydroquinine and the two enantiomers of N-(3,5-dinitrobenzoyl)alanine methyl ester ," Tetrahedron: Asymmetry , 2008, 19, 1084–1093
  • ö indicates papers (co)authored by Schrödinger scientist(s).
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