William L. Jorgensen (born October 5, 1949, New York) is a Sterling Professor of Chemistry at Yale University. He is considered a pioneer in the field of computational chemistry. Some of his contributions include the TIP3P, TIP4P, and TIP5P water models, the OPLS force field, and his work on free-energy perturbation theory for modeling reactions in solution, protein-ligand binding, and
drug design; he has over 450 publications in the field. Jorgensen was the Editor of the ACS Journal of Chemical Theory and Computation from its founding in 2005 until 2022.
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