Simulation of conformational changes in 2 Zn insulin

<scp>CHARMM</scp>: A program for macromolecular energy, minimization, and dynamics calculations

Bernard R. Brooks, Robert E. Bruccoleri, Barry D. Olafson et al. · Journal of Computational Chemistry · 1983 · 14.9K citations

Natural Sciences, Chemistry, Biomolecular Modeling +13

The protein data bank: A computer-based archival file for macromolecular structures

F. C. Bernstein, Thomas F. Koetzle, G. J. B. Williams et al. · Journal of Molecular Biology · 1977 · 8.6K citations

Life Sciences, Biochemistry, Bioinformatics +14

Function minimization by conjugate gradients

R. Fletcher · The Computer Journal · 1964 · 4.9K citations · Full text

Natural Sciences, Mathematics, Algorithms +9

IUPAC-IUB Commission on Biochemical Nomenclature. Abbreviations and symbols for the description of the conformation of polypeptide chains. Tentative rules (1969)

IUPAC-IUB Comm. on Biochem. Nomenclature · Biochemistry · 1970 · 907 citations

Life Sciences, Biochemistry, Chemistry +14

Gene duplications in the structural evolution of chymotrypsin

A. McLachlan · Journal of Molecular Biology · 1979 · 502 citations

Life Sciences, Genetics, Molecular Biology +14