Synthesis of 4-amino-3-oxo-tetrahydroazepino[3,4-b]indoles: new conformationally constrained Trp analogs

Macromodel—an integrated software system for modeling organic and bioorganic molecules using molecular mechanics

F. MOHAMADI, Nigel G. J. Richards, Wayne C. Guida et al. · Journal of Computational Chemistry · 1990 · 3.8K citations

Natural Sciences, Chemistry, Biomolecular Modeling +13

Semianalytical treatment of solvation for molecular mechanics and dynamics

W. Clark Still, Anna Tempczyk, Ronald C. Hawley et al. · Journal of the American Chemical Society · 1990 · 3.7K citations

Natural Sciences, Chemistry, Computational Chemistry +16

Molecular mechanics. The MM3 force field for hydrocarbons. 1

Norman L. Allinger, Y. Yuh, Jenn Huei Lii · Journal of the American Chemical Society · 1989 · 2.8K citations

Natural Sciences, Chemistry, Physics +14

Determination ofD-amino acids. II. Use of a bifunctional reagent, 1,5-difluoro-2,4-dinitrobenzene

Peter S. Marfey · Carlsberg Research Communications · 1984 · 1.4K citations · Full text

Natural Sciences, Biochemistry, Chemistry +7

Low Mode Search. An Efficient, Automated Computational Method for Conformational Analysis:  Application to Cyclic and Acyclic Alkanes and Cyclic Peptides

Journal of the American Chemical Society · 1996 · 419 citations

Natural Sciences, Chemistry, Biomolecular Modeling +9