Pharmacology and Toxicology

Environmentally-Friendly Workflow Based on Supercritical Fluid Chromatography and Tandem Mass Spectrometry Molecular Networking For the Discovery of Potent Anti-Viral Leads From Plants
Louis-Félix Nothias, Stéphanie Boutet-Mercey, Xavier Cachet, Erick De La Torre, Laurent Laboureur, Jean-François Gallard, Pascal Retailleau, Alain Brunelle, Pieter C. Dorrestein, Jean Costa, Luis M. Bedoya, Fanny Roussi, Pieter Leyssen, José Alcami, Julien Paolini, Marc Litaudon, David Touboul

bioRxiv 106153; doi: https://doi.org/10.1101/106153

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Mendelian randomization: a novel approach for the prediction of adverse drug events and drug repurposing opportunities
Venexia M Walker, George Davey Smith, Neil M Davies, Richard M Martin

bioRxiv 105338; doi: https://doi.org/10.1101/105338

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Progress Towards a Public Chemogenomic Set for Protein Kinases and a Call for Contributions
David H. Drewry, Carrow I. Wells, David M. Andrews, Richard Angell, Hassan Al-Ali, Alison D. Axtman, Stephen J. Capuzzi, Jonathan M. Elkins, Peter Ettmayer, Mathias Frederiksen, Opher Gileadi, Nathanael Gray, Alice Hooper, Stefan Knapp, Stefan Laufer, Ulrich Luecking, Susanne Müller, Eugene Muratov, R. Aldrin Denny, Kumar S. Saikatendu, Daniel K. Treiber, William J. Zuercher, Timothy M. Willson

bioRxiv 104711; doi: https://doi.org/10.1101/104711

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Approaches for calculating solvation free energies and enthalpies demonstrated with an update of the FreeSolv database
Guilherme Duarte Ramos Matos, Daisy Y. Kyu, Hannes H. Loeffler, John D. Chodera, Michael R. Shirts, David L. Mobley

bioRxiv 104281; doi: https://doi.org/10.1101/104281

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The Importance of Reverse Translation for Preclinical Off-Target Mitigation: Quantification and Mitigation of Biases in the FDA Adverse Event Reporting System
Mateusz Maciejewski, Eugen Lounkine, Steven Whitebread, Pierre Farmer, Bill DuMouchel, Brian K. Shoichet, Laszlo Urban

bioRxiv 068692; doi: https://doi.org/10.1101/068692

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Estrogen and Soy Isoflavonoids Decrease Sensitivity of Medulloblastoma and Central Nervous System Primitive Neuroectodermal Tumor Cells to Chemotherapeutic Cytotoxicity
Scott M. Belcher, Caleb C. Burton, Clifford J. Cookman, Michelle Kirby, Gabriel L. Miranda, Fatima Saeed, Kathleen E. Wray

bioRxiv 100107; doi: https://doi.org/10.1101/100107

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The Environmental Risks of neonicotinoid pesticides: a review of the evidence post-2013
Thomas James Wood, Dave Goulson

bioRxiv 098897; doi: https://doi.org/10.1101/098897 Confirmatory Results

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Insights into the binding mode of MEK type-III inhibitors. A step towards discovering and designing allosteric kinase inhibitors across the human kinome
Zheng Zhao, Lei Xie, Philip E. Bourne

bioRxiv 076711; doi: https://doi.org/10.1101/076711

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Drug repurposing for ageing research using model organisms
Matthias Ziehm, Satwant Kaur, Dobril K. Ivanov, Pedro J. Ballester, David Marcus, Linda Partridge, Janet M. Thornton

bioRxiv 095380; doi: https://doi.org/10.1101/095380

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Perfluorooctane sulfonate affects proliferation and differentiation of pluripotent human teratocarcinoma cells
Mina Popovic, Brett A. Neilan, Francesco Pomati

bioRxiv 089698; doi: https://doi.org/10.1101/089698

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Pharmacology and Toxicology

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