Optimal decision-making in high-throughput virtual screening pipelines
Summary: The need for efficient computational screening of molecular candidates that possess desired properties frequently arises in various scientific and engineering problems, including drug discovery and materials design. However, the enormous search space containing the candidates and the substa...
| Main Authors: | , , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2023-11-01
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| Series: | Patterns |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2666389923002672 |