Enhancing Accuracy and Feature Insights in Hydration Free Energy Predictions for Small Molecules with Machine Learning
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| Main Authors: | Mingjun Han, Yukai Zhang, Taotao Yu, Guodong Du, ChiYung Yam, Ho-Kin Tang |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
American Chemical Society
2025-07-01
|
| Series: | ACS Omega |
| Online Access: | https://doi.org/10.1021/acsomega.5c04249 |
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