Journal Articles
Journal of Molecular Modeling
Year : 2014
Jean-Philip Piquemal : Connect in order to contact the contributor
https://hal.science/hal-02126794
Submitted on : Sunday, May 12, 2019-9:52:26 PM
Last modification on : Friday, June 2, 2023-3:14:38 PM
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Elodie Goldwaser, Benoit de Courcy, Luc Demange, Christiane Garbay, Françoise Raynaud, et al.. Conformational analysis of a polyconjugated protein-binding ligand by joint quantum chemistry and polarizable molecular mechanics. Addressing the issues of anisotropy, conjugation, polarization, and multipole transferability. Journal of Molecular Modeling, 2014, 20 (11), ⟨10.1007/s00894-014-2472-5⟩. ⟨hal-02126794⟩
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