Experimental Uncertainty in Training Data for Protein-Ligand Binding Affinity Prediction Models
The accuracy of machine learning models for protein-ligand binding affinity prediction depends on the quality of the experimental data they are trained on. Most of these models are trained and tested on different subsets of the PDBbind database, which is the main source of protein-ligand complexes w...
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| Principais autores: | , |
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| Format: | Artigo |
| Sprog: | Inglês |
| Udgivet: |
Elsevier
2023-12-01
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| Serier: | Artificial Intelligence in the Life Sciences |
| Fag: | |
| Online adgang: | http://www.sciencedirect.com/science/article/pii/S2667318523000314 |
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