Antonio Llinàs
0000-0003-4620-9363
11 papers found
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Blinded Predictions and Post Hoc Analysis of the Second Solubility Challenge Data: Exploring Training Data and Feature Set Selection for Machine and Deep Learning Models
Findings of the Second Challenge to Predict Aqueous Solubility ꝉ Dedicated to the memory of Anton J. Hopfinger and Oleg A. Raevsky
Identification and Optimization of Pyrrolidine Derivatives as Highly Potent Ghrelin Receptor Full Agonists
Multisolvent Models for Solvation Free Energy Predictions Using 3D-RISM Hydration Thermodynamic Descriptors
Discovery of Potent and Orally Bioavailable Inverse Agonists of the Retinoic Acid Receptor-Related Orphan Receptor C2
Solubility Challenge Revisited after Ten Years, with Multilab Shake-Flask Data, Using Tight (SD ∼ 0.17 log) and Loose (SD ∼ 0.62 log) Test Sets
Derisking Development by a Cocrystallization Screen of a Novel Selective Inhaled JAK-STAT inhibitor
Potent and Orally Bioavailable Inverse Agonists of RORγt Resulting from Structure-Based Design
Identification and Pharmacological Profile of an Indane Based Series of Ghrelin Receptor Full Agonists
Discovery of a Novel Oral Glucocorticoid Receptor Modulator (AZD9567) with Improved Side Effect Profile
Property prediction and pharmacokinetic evaluation of mixed stoichiometry cocrystals of zafirlukast, a drug delivery case study
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