"System truncation accelerates binding affinity calculations with the ..."

Shinya Nakamura et al. (2023)

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DOI: 10.1002/JCC.27044

access: closed

type: Journal Article

metadata version: 2023-02-25

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Shinya Nakamura, Tatsuo Akaki, Keiji Nishiwaki, Midori Nakatani, Yuji Kawase, Yuki Takahashi, Isao Nakanishi:
System truncation accelerates binding affinity calculations with the fragment molecular orbital method: A benchmark study. J. Comput. Chem. 44(7): 824-831 (2023)

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