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- [22] Unconventional Catalytic Mechanism for histone deacetylase suggested by a DFT-QM/MM study ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2006, 231
- [28] A Semiempirical QM/MM Implementation and its Application to the Absorption of Organic Molecules in Zeolites Molecular modeling annual, 1999, 5 : 1 - 7
- [29] Implementation and assessment of the AMOEBA water model for fully polarizable QM/MM calculations ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 252
- [30] Understanding Rhodopsin Mutations Linked to the Retinitis pigmentosa Disease: a QM/MM and DFT/MRCI Study JOURNAL OF PHYSICAL CHEMISTRY B, 2012, 116 (03): : 1060 - 1076