Heterogeneous graph convolutional neural network for protein-ligand scoring
Aim: Drug discovery is a long process, often taking decades of research endeavors. It is still an active area of research in both academic and industrial sectors with efforts on reducing time and cost. Computational simulations like molecular docking enable fast exploration of large databases of com...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Open Exploration
2023-04-01
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| Series: | Exploration of Drug Science |
| Subjects: | |
| Online Access: | https://www.explorationpub.com/uploads/Article/A100810/100810.pdf |