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List of works by Dhruva K Chakravorty

Hybrid quantum/classical molecular dynamics simulations of the proton transfer reactions catalyzed by ketosteroid isomerase: analysis of hydrogen bonding, conformational motions, and electrostatics

scientific article published on November 2009

Impact of mutation on proton transfer reactions in ketosteroid isomerase: insights from molecular dynamics simulations

scientific article published on June 2010

Implementation of umbrella integration within the framework of the empirical valence bond approach

scientific article published in January 2008

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