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Target Profile Prediction and Practical Evaluation of a Biginelli-Type Dihydropyrimidine Compound Library

We present a self-organizing map (SOM) approach to predicting macromolecular targets for combinatorial compound libraries. The aim was to study the usefulness of the SOM in combination with a topological pharmacophore representation (CATS) for selecting biologically active compounds from a virtual c...

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Détails bibliographiques
Auteurs principaux: Schneider, Petra, Stutz, Katharina, Kasper, Ladina, Haller, Sarah, Reutlinger, Michael, Reisen, Felix, Geppert, Tim, Schneider, Gisbert
Format: Artigo
Langue:Inglês
Publié: MDPI 2011
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Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC4058656/
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ph4091236
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