Method evidence record
Pharmacophore Modeling
Pharmacophore modeling identifies the spatial arrangement of molecular features (hydrogen bond donors, acceptors, aromatic rings) that are essential for biological activity. Introduced by Gund in 1977, this ligand-based method creates a three-dimensional pattern that can screen chemical libraries and design new active compounds without requiring receptor structure.
Source record
Citations copied verbatim from the method’s source record. No claim-level verification is inferred from them.
Pharmacophore-based Ligand Design and Virtual Screening
Taxonomic method record · process-pipeline / bioinformatics
- Wermuth, C. G., Ganellin, C. R., Lindberg, P., & Mitscher, L. A. (1998). Glossary of terms used in medicinal chemistry. Pure and Applied Chemistry, 70(5), 1129-1143. · DOI 10.1351/pac199870051129
- Ohno, K. & Ueda, Y. (2006). Modern photochemistry of organic compounds. Wiley & Sons. · URL
- Leung, S. C., Bodkin, M., von Delft, F., & Morris, G. M. (2012). SiteMap: a tool for identifying and characterizing binding sites in protein structures. Journal of Chemical Information and Modeling, 52(11), 3008-3020. · URL
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Related methods
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