New insights about HERG blockade obtained from protein modeling, potential energy mapping, and docking studies

Bioorganic & Medicinal Chemistry - Tập 14 - Trang 3160-3173 - 2006
Ramy Farid1, Tyler Day1, Richard A. Friesner2, Robert A. Pearlstein1
1Schrödinger, Inc., 120 West Forty-Fifth Street, 32nd Floor, New York, NY 10036, USA
2Department of Chemistry, Columbia University, New York, NY 10036, USA

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