Quantum Chemical and QM/MM Models in Biochemistry
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Publisher
Springer New York
Link
http://link.springer.com/content/pdf/10.1007/978-1-4939-9608-7_4
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5. Warshel A, Karplus M (1972) Calculation of ground and excited state potential surfaces of conjugated molecules. I. Formulation and parametrization. J Am Chem Soc 94:5612–5625
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