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Jacob Oscar Spiegel, Ph.D. - Publications

Affiliations: 
2013-2020 Molecular Biophysics and Structural Biology University of Pittsburgh, Pittsburgh, PA, United States 
Area:
Computer-Aided Drug Design, PARP-1, Computational Biology, Cheminformatics
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6 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2022 Spiegel J, Senderowitz H. Towards an Enrichment Optimization Algorithm (EOA)-based target specific docking functions for virtual screening. Molecular Informatics. PMID 35790469 DOI: 10.1002/minf.202200034  0.345
2021 Spiegel J, Senderowitz H. A Comparison between Enrichment Optimization Algorithm (EOA)-Based and Docking-Based Virtual Screening. International Journal of Molecular Sciences. 23. PMID 35008467 DOI: 10.3390/ijms23010043  0.37
2021 Spiegel JO, Van Houten B, Durrant JD. PARP1: Structural insights and pharmacological targets for inhibition. Dna Repair. 103: 103125. PMID 33940558 DOI: 10.1016/j.dnarep.2021.103125  0.455
2020 Spiegel JO, Durrant JD. AutoGrow4: an open-source genetic algorithm for de novo drug design and lead optimization. Journal of Cheminformatics. 12: 25. PMID 33431021 DOI: 10.1186/s13321-020-00429-4  0.618
2020 Spiegel JO, Durrant JD. AutoGrow4: an open-source genetic algorithm for de novo drug design and lead optimization Journal of Cheminformatics. 12. DOI: 10.1186/S13321-020-00429-4  0.575
2019 Ropp PJ, Spiegel JO, Walker JL, Green H, Morales GA, Milliken KA, Ringe JJ, Durrant JD. Gypsum-DL: an open-source program for preparing small-molecule libraries for structure-based virtual screening. Journal of Cheminformatics. 11: 34. PMID 31127411 DOI: 10.1186/S13321-019-0358-3  0.494
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