"A machine learning correction for DFT non-covalent interactions based on ..."

Ting Gao et al. (2016)

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DOI: 10.1186/S13321-016-0133-7

access: open

type: Journal Article

metadata version: 2023-02-08

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Ting Gao, Hong-Zhi Li, Wenze Li, Lin Li, Chao Fang, Hui Li, Li Hong Hu, Yinghua Lu, Zhongmin Su:
A machine learning correction for DFT non-covalent interactions based on the S22, S66 and X40 benchmark databases. J. Cheminformatics 8(1): 24:1-24:17 (2016)

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