"Coordinate-Free and Low-Order Scaling Machine Learning Model for Atomic ..."

Qin Xie, Andrew P. Horsfield (2024)

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DOI: 10.1021/ACS.JCIM.4C00376

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type: Journal Article

metadata version: 2024-08-22

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Qin Xie, Andrew P. Horsfield:
Coordinate-Free and Low-Order Scaling Machine Learning Model for Atomic Partial Charge Prediction for Any Size of Molecules. J. Chem. Inf. Model. 64(11): 4419-4425 (2024)

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