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The Computational Chemical Biology conference is Chaired by Ross Walker (University of California San Diego) and Ian Gould (Imperial College London) will bring together scientists to discuss multidisciplinary research that leverages computer simulation to address key questions crossing the physical sciences-life sciences/biomedical interface.
Topics will include advances in molecular dynamics simulation of enzymes; computational approaches to studying the interaction of drugs, drug transporters and signaling enzymes with lipid membranes; simulation of protein-protein interaction and multi-protein complex enzymatic systems; computational study of signaling pathways; new techniques in computational drug discovery as they apply to enzyme reactivity and dynamics; simulation of allosteric interactions; advances in multi-scale modeling; new techniques for direct simulation of reactivity in biological systems; and the impact of technological advances in computer hardware and software on the field of chemical biology.
