A Deep-Learning Approach toward Rational Molecular Docking Protocol Selection
While a plethora of different protein–ligand docking protocols have been developed over the past twenty years, their performances greatly depend on the provided input protein–ligand pair. In this study, we developed a machine-learning model that uses a combination of convolutional and fully connecte...
| Published in: | Molecules |
|---|---|
| Main Authors: | , , , , |
| Format: | Article |
| Language: | English |
| Published: |
MDPI AG
2020-05-01
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| Subjects: | |
| Online Access: | https://www.mdpi.com/1420-3049/25/11/2487 |