Simple formulas for improved point-charge electrostatics in classical force fields and hybrid quantum mechanical/molecular mechanical embedding.
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| Title: | Simple formulas for improved point-charge electrostatics in classical force fields and hybrid quantum mechanical/molecular mechanical embedding. |
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| Authors: | Cisneros, G. A.1 (AUTHOR), Tholander, S. Na‐Im2,3 (AUTHOR), Parisel, O.2,3 (AUTHOR), Darden, T. A.1 (AUTHOR), Elking, D.1 (AUTHOR), Perera, L.1 (AUTHOR), Piquemal, J.‐P.2,3 (AUTHOR) jpp@lct.jussieu.fr |
| Source: | International Journal of Quantum Chemistry. 2008, Vol. 108 Issue 11, p1905-1912. 8p. 2 Diagrams, 1 Chart, 3 Graphs. |
| Database: | Academic Search Ultimate |
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