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Expert Opinion on Drug Discovery|March 14, 2013
Computational methods to support high-content screening: from compound selection and data analysis to postulating target hypothesesAnne Kümmel, Daniela Gabriel, Christian N Parker, et al.
Journal of Cheminformatics|January 12, 2021
QSAR-derived affinity fingerprints (part 2): modeling performance for potency predictionIsidro Cortés-Ciriano, Ctibor Škuta, Andreas Bender, et al.
Journal of Chemical Information and Modeling|March 28, 2006
Harvesting chemical information from the Internet using a distributed approach: ChemXtremeM Karthikeyan, S Krishnan, Anil Kumar Pandey, et al.
Malaria Journal|April 13, 2018
A systematic and prospectively validated approach for identifying synergistic drug combinations against malariaYasaman KalantarMotamedi, Richard T Eastman, Rajarshi Guha, et al.
ACS Chemical Biology|February 17, 2016
Analysis of Iterative Screening with Stepwise Compound Selection Based on Novartis In-house HTS DataShardul Paricharak, Adriaan P IJzerman, Andreas Bender, et al.
Journal of Clinical Gastroenterology|February 15, 2019
More Severe Deficits in Performance Status at Time of Liver Transplant is Associated With Significantly Higher Risk of Death Following Liver TransplantationPatrick McCabe, Robert G Gish, Ramsey Cheung, et al.
Journal of Chemical Theory and Computation|September 12, 2017
Use of Crystal Structure Informatics for Defining the Conformational Space Needed for Predicting Crystal Structures of Pharmaceutical MoleculesLuca Iuzzolino, Anthony M Reilly, Patrick McCabe, et al.
Clinical & Experimental Metastasis|May 29, 2008
Intraosseous injection of RM1 murine prostate cancer cells promotes rapid osteolysis and periosteal bone depositionN Patrick McCabe, Maria Madajka, Amit Vasanji, et al.
Current Protocols in Chemical Biology|September 5, 2019
Elucidating Compound Mechanism of Action and Predicting Cytotoxicity Using Machine Learning Approaches, Taking Prediction Confidence into AccountGeorgios Drakakis, Isidro Cortés-Ciriano, Ben Alexander-Dann, et al.
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