Automated Fragmentation QM/MM Calculation of NMR Chemical Shifts for Protein-Ligand Complexes

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Automated Fragmentation QM/MM Calculation of NMR Chemical Shifts for Protein-Ligand Complexes: Xinsheng Jin, Tong Zhu, John Z. H. Zhang, Xiao He https://t.co/H0DSXRKJzB

08 May 2018

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