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"Combined ab initio/empirical approach for optimization of Lennard-Jones ..."
Daxu Yin, Alexander D. MacKerell Jr. (1998)
- Daxu Yin, Alexander D. MacKerell Jr.:
Combined ab initio/empirical approach for optimization of Lennard-Jones parameters. J. Comput. Chem. 19(3): 334-348 (1998)
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