#drug discovery — Tuesday, March 10, 2026 (2 items)
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Unified protein-small molecule graph neural networks for binding site prediction.
(pnas.org)
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PNAS 2026-03-10 | #modeling #prediction #binding #drug discovery | |
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Identification of novel pyrazolo[4,3-c]pyridine and diazepane derivatives as potent inhibitors of Mycobacterium tuberculosis protein tyrosine phosphatase B.
(journals.asm.org)
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Infection and Immunity 2026-03-10 | #virulence #drug discovery #inhibitor #docking #tb |