Dr Prakash Rathi
CCI-Structural Bioinformatics, Astex Pharmaceuticals
CCI-Structural Bioinformatics, Astex Pharmaceuticals
Verdonk, M. L.; Ludlow, R. F.; Giangreco, I.; Rathi, P. C. Protein-Ligand-Informatics force field (PLIff): towards a fully knowledge driven “force field” for biomolecular interactions. J. Med. Chem., 2016; DOI: 10.1021/acs.jmedchem.6b00716
Rathi, P. C.; Ludlow, R. F.; Hall, R. J.; Murray, C. W.; Mortenson, P. N.; Verdonk, M. L. Predicting “Hot” and “Warm” Spots for Fragment Binding. J. Med. Chem., 2017; DOI: 10.1021/acs.jmedchem.7b00366