Explainable Solvation Free Energy Prediction Combining Graph Neural Networks with Chemical Intuition.

Details

Language :

English

ISSN :

15499596

Volume :

62

Issue :

22

Database :

Supplemental Index

Journal :

Journal of Chemical Information & Modeling

Publication Type :

Academic Journal

Accession number :

160500845

Full Text :

https://doi.org/10.1021/acs.jcim.2c01013