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Bioactivation of Isoxazole-Containing Bromodomain and Extra-Terminal Domain (BET) Inhibitors.
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- Metabolites (2218-1989), 2021, v. 11, n. 6, p. 390, doi. 10.3390/metabo11060390
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- Article
Deep learning the structural determinants of protein biochemical properties by comparing structural ensembles with DiffNets.
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- Nature Communications, 2021, v. 12, n. 1, p. 1, doi. 10.1038/s41467-021-23246-1
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- Article
Accounting for noise when clustering biological data.
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- Briefings in Bioinformatics, 2013, v. 14, n. 4, p. 423, doi. 10.1093/bib/bbs057
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Mining small-molecule screens to repurpose drugs.
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- Briefings in Bioinformatics, 2011, v. 12, n. 4, p. 327, doi. 10.1093/bib/bbr028
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- Article
Erratum: Inhibition of DNA Methyltransferases Blocks Mutant Huntingtin-Induced Neurotoxicity.
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- Scientific Reports, 2016, p. 33766, doi. 10.1038/srep33766
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- Article
Discovery of Novel Reductive Elimination Pathway for 10-Hydroxywarfarin.
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- Frontiers in Pharmacology, 2022, v. 12, p. 1, doi. 10.3389/fphar.2021.805133
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- Article
Securely Measuring the Overlap between Private Datasets with Cryptosets.
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- PLoS ONE, 2015, v. 10, n. 2, p. 1, doi. 10.1371/journal.pone.0117898
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Probabilistic Substructure Mining From Small-Molecule Screens.
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- Molecular Informatics, 2011, v. 30, n. 9, p. 809, doi. 10.1002/minf.201100058
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- Article
Novel Bioactivation of Isoxazole‐containing Bromodomain and Extra Terminal Domain (BET) Inhibitors.
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- FASEB Journal, 2021, v. 35, p. N.PAG, doi. 10.1096/fasebj.2021.35.S1.04681
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- Article
A survey of current trends in computational drug repositioning.
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- Briefings in Bioinformatics, 2016, v. 17, n. 1, p. 2, doi. 10.1093/bib/bbv020
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- Article
Machine learning liver-injuring drug interactions with non-steroidal anti-inflammatory drugs (NSAIDs) from a retrospective electronic health record (EHR) cohort.
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- PLoS Computational Biology, 2021, v. 17, n. 7, p. 1, doi. 10.1371/journal.pcbi.1009053
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- Article
Bigger data, collaborative tools and the future of predictive drug discovery.
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- Journal of Computer-Aided Molecular Design, 2014, v. 28, n. 10, p. 997, doi. 10.1007/s10822-014-9762-y
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- Article
Managing missing measurements in small-molecule screens.
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- Journal of Computer-Aided Molecular Design, 2013, v. 27, n. 5, p. 469, doi. 10.1007/s10822-013-9642-x
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- Article
Accuracy of 3D Printed Models Created by Two Technologies of Printers with Different Designs of Model Base.
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- Journal of Prosthodontics, 2020, v. 29, n. 2, p. 124, doi. 10.1111/jopr.13107
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- Article
Education: Initiatives to bridge faith and science.
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- Nature, 2015, v. 523, n. 7562, p. 531, doi. 10.1038/523531b
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ChemDB update full-text search and virtual chemical space.
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- Bioinformatics, 2007, v. 23, n. 17, p. 2348, doi. 10.1093/bioinformatics/btm341
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- Article
ChemDB: a public database of small molecules and related chemoinformatics resources.
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- Bioinformatics, 2005, v. 21, n. 22, p. 4133, doi. 10.1093/bioinformatics/bti683
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- Article
Kernels for small molecules and the prediction of mutagenicity, toxicity and anti-cancer activity.
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- Bioinformatics, 2005, v. 21, p. i359, doi. 10.1093/bioinformatics/bti1055
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- Article
Kernels for small molecules and the prediction of mutagenicity, toxicity and anti-cancer activity.
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- Bioinformatics, 2005, v. 21, n. 1, p. i359, doi. 10.1093/bioinformatics/bti1055
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- Article
Development and Validation of a Deep Learning Model to Quantify Glomerulosclerosis in Kidney Biopsy Specimens.
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- JAMA Network Open, 2021, v. 4, n. 1, p. 1, doi. 10.1001/jamanetworkopen.2020.30939
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Editorial: Advancements in computational studies of drug toxicity.
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- Frontiers in Pharmacology, 2023, p. 1, doi. 10.3389/fphar.2023.1230409
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The Overlooked Science of Genealogical Ancestry.
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- Perspectives on Science & Christian Faith, 2018, v. 70, n. 1, p. 19
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BEESEM: estimation of binding energy models using HT-SELEX data.
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- Bioinformatics, 2017, v. 33, n. 15, p. 2288, doi. 10.1093/bioinformatics/btx191
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A simple model predicts UGT-mediated metabolism.
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- Bioinformatics, 2016, v. 32, n. 20, p. 3183, doi. 10.1093/bioinformatics/btw350
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- Article
Statistically identifying tumor suppressors and oncogenes from pan-cancer genome-sequencing data.
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- Bioinformatics, 2015, v. 31, n. 22, p. 3561, doi. 10.1093/bioinformatics/btv430
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- Article
Extending P450 site-of-metabolism models with region-resolution data.
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- Bioinformatics, 2015, v. 31, n. 12, p. 1966, doi. 10.1093/bioinformatics/btv100
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XenoSite server: a web-available site of metabolism prediction tool.
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- Bioinformatics, 2015, v. 31, n. 7, p. 1136, doi. 10.1093/bioinformatics/btu761
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- Article
Scaffold network generator: a tool for mining molecular structures.
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- Bioinformatics, 2013, v. 29, n. 20, p. 2655, doi. 10.1093/bioinformatics/btt448
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RS-WebPredictor: a server for predicting CYP-mediated sites of metabolism on drug-like molecules.
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- Bioinformatics, 2013, v. 29, n. 4, p. 497, doi. 10.1093/bioinformatics/bts705
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- Article
Enhancing the rate of scaffold discovery with diversity-oriented prioritization.
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- Bioinformatics, 2011, v. 27, n. 16, p. 2271, doi. 10.1093/bioinformatics/btr369
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A CROC stronger than ROC: measuring, visualizing and optimizing early retrieval.
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- Bioinformatics, 2010, v. 26, n. 10, p. 1348, doi. 10.1093/bioinformatics/btq140
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