Author

Malcolm J. McGregor

SRI International

Listed by name: these papers carry no ORCID for this author, so different people with the same name may be mixed together.

Biology Disciplines

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Bioinformatics· 1

Signature Assays, Organisms & Methods

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Approach:deep learning· 1 Research Focus:drug response / drug discovery· 1 Assay:protein structure· 1 Research Focus:software / tool· 1

Frequent Co-Authors

Steven M. MuskaliD· 1 shared

Activity by Year

2026-2026 · peak 1/yr

1 paper

Recent·Most cited

PharmCast: rapid generation of three-dimensional pharmacophore fingerprints from two-dimensional structure without conformer generation

Steven M. Muskal, Malcolm J. McGregor

A feedforward network predicts 10,549-bit ensemble pharmacophore fingerprints from SMILES without conformers: 0.584 ms versus 5.71 s per pair comparison, with median MCC 0.860 to 0.914.

bioRxiv · Sep 8, 2026 · PreprintBioinformatics✦ In-depth digest