Gaussian docking functions
Abstract A shape‐based Gaussian docking function is constructed which uses Gaussian functions to represent the shapes of individual atoms. A set of 20 trypsin ligand–protein com...
Publications
3 shownClassical Electrostatics in Biology and Chemistry
A major revival in the use of classical electrostatics as an approach to the study of charged and polar molecules in aqueous solution has been made possible through the developm...
Frequent Co-Authors
Researcher Info
- h-index
- 3
- Publications
- 3
- Citations
- 3,535
- Institution
- Columbia University
External Links
Identifiers
- ORCID
- 0000-0001-8488-9641
Impact Metrics
h-index
3
h-index: Number of publications with at least h citations each.