PHASE: A Novel Approach to Pharmacophore Modeling and 3D Database Searching Posted on September 8, 2015December 13, 2024 by Anonymous
Novel inverse binding mode of indirubin derivatives yields improved selectivity for DYRK kinases Posted on September 8, 2015December 13, 2024 by Anonymous
Search for Non-Nucleoside Inhibitors of HIV-1 Reverse Transcriptase Using Chemical Similarity, Molecular Docking, and MM-GB/SA Scoring Posted on September 8, 2015December 13, 2024 by Anonymous
Dihydropyridopyrazinones and Dihydropteridinones as Corticotropin-Releasing Factor-1 Receptor Antagonists: Structure-Activity Relationships and Computational Modeling Posted on September 8, 2015December 13, 2024 by Anonymous
Computer-aided drug design of falcipain inhibitors: Virtual screening, structure-activity relationships, hydration site thermodynamics, and reactivity analysis Posted on September 8, 2015December 13, 2024 by Anonymous
Computer-Aided Design of Non-Nucleoside Inhibitors of HIV-1 Reverse Transcriptase Posted on September 8, 2015December 13, 2024 by Anonymous
Thermodynamic analysis of water molecules at the surface of proteins and applications to binding site prediction and characterization Posted on September 8, 2015December 13, 2024 by Anonymous
Solution-Phase Synthesis of a Tricyclic Pyrrole-2-Carboxamide Discovery Library Applying a Stetter-Paal-Knorr Reaction Sequence Posted on September 8, 2015December 13, 2024 by Anonymous
Mechanism of the hydrophobic effect in the biomolecular recognition of arylsulfonamides by carbonic anhydrase Posted on September 8, 2015December 13, 2024 by Anonymous
Influence of Molecular Flexibility and Polar Surface Area Metrics on Oral Bioavailability in the Rat Posted on September 8, 2015December 13, 2024 by Anonymous
Rational approaches to improving selectivity in drug design Posted on September 8, 2015December 13, 2024 by Anonymous
QSAR Studies of PC-3 Cell Line Inhibition Activity of TSA and SAHA-like Hydroxamic Acids Posted on September 8, 2015December 13, 2024 by Anonymous