Proceedings of the National Academy of Sciences of the United States of America, Vol. 103, No. 22 (May 30, 2006), pp. 8331-8336 (6 pages) Continuum solvation models provide appealing alternatives to ...
The study of electrostatics and solvation in molecular simulations is pivotal for understanding the behaviour of biomolecules in their native environments. Electrostatic interactions govern processes ...
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