Malcolm D. Walkinshaw

Publication Activity (10 Years)

Years Active: 1988-2013
Publications (10 Years): 0

Top Topics

Virtual Screening

Multi Dimensional

Top Venues

J. Chem. Inf. Model.

Publications

Douglas R. Houston, Malcolm D. Walkinshaw
Consensus Docking: Improving the Reliability of Docking in a Virtual Screening Context. J. Chem. Inf. Model. 53 (2) (2013)
Chian Teo, Steven R. Shave, Adam Leow Thean Chor, Abu Salleh, Mohd Basyaruddin Abdul Rahman, Malcolm D. Walkinshaw, Bimo Ario Tejo
Discovery of a new class of inhibitors for the protein arginine deiminase type 4 (PAD4) by structure-based virtual screening. BMC Bioinform. 13 (S-17) (2012)
Kun-Yi Hsin, Hugh P. Morgan, Steven R. Shave, Andrew C. Hinton, Paul Taylor, Malcolm D. Walkinshaw
EDULISS: a small-molecule database with data-mining and pharmacophore searching capabilities. Nucleic Acids Res. 39 (Database-Issue) (2011)
Wissam Mehio, Graham J. L. Kemp, Paul Taylor, Malcolm D. Walkinshaw
Identification of protein binding surfaces using surface triplet propensities. Bioinform. 26 (20) (2010)
Nicos Angelopoulos, Andreas Hadjiprocopis, Malcolm D. Walkinshaw
Bayesian Model Averaging for Ligand Discovery. J. Chem. Inf. Model. 49 (6) (2009)
Steven R. Shave, Paul Taylor, Malcolm D. Walkinshaw, Lorna Smith, Judy Hardy, Arthur S. Trew
Ligand discovery on massively parallel systems. IBM J. Res. Dev. 52 (1-2) (2008)
Malcolm D. Walkinshaw
The 1988 Oholo Conference. J. Comput. Aided Mol. Des. 2 (2) (1988)