Prediction of Secondary Ionization of the Phosphate Group in Phosphotyrosine Peptides

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

Structural Bioinformatics, Biomolecular Structure Prediction, Protein Folding +13

Why Nature Chose Phosphates

F. H. Westheimer · Science · 1987 · 1.7K citations

Biology, Phosphoric Acid, Phosphate Esters +15

pKa's of ionizable groups in proteins: atomic detail from a continuum electrostatic model

Donald Bashford, Martin Karplus · Biochemistry · 1990 · 1.1K citations

Crystal Structure, Engineering, Pka Perturbations +20

Prediction of Ph-dependent Properties of Proteins

Jan Antosiewicz, J. Andrew McCammon, Michael K. Gilson · Journal of Molecular Biology · 1994 · 817 citations

Protein Chemistry, Ph-dependent Properties, Biochemistry +7

Electrostatics and diffusion of molecules in solution: simulations with the University of Houston Brownian Dynamics program

Jeffry D. Madura, James M. Briggs, Rebecca C. Wade et al. · Computer Physics Communications · 1995 · 807 citations

Engineering, Physics, Applied Physics +7