The Fourth Volume of Bentham’s Computational Chemistry Book Series

Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity.


About The Editors:

Dr. Qasmi has over 100 research publications in computational chemistry, four patent and seven books or chapter written or edited. He is Editorial Board Member of J. of Molecular Graphics and Modeling, and Current Computer Aided Drug Design. Current research interests include molecular dynamics simulation of any systems of pharmaceutical and biological interest, design of new bio-active molecules using computer aided modeling techniques, modeling of small organic molecules, proteins, and protein-ligand interactions, ligand based and structure based pharmacophore design

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