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收藏Polarizable Molecular Dynamics in a Polarizable Continuum Solvent
Lipparini, Filippo; Lagardere, Louis; Raynaud, Christophe; Stamm, Benjamin; Cances, Eric; Mennucci, Benedetta; Schnieders, Michael; Ren, Pengyu; Maday, Yvon; Piquemal, Jean-Philip
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收藏Quantum, classical, and hybrid QM/MM calculations in solution: General implementation of the ddCOSMO linear scaling strategy
Lipparini, Filippo; Scalmani, Giovanni; Lagardere, Louis; Stamm, Benjamin; Cances, Eric; Maday, Yvon; Piquemal, Jean-Philip; Frisch, Michael J.; Mennucci, Benedetta
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