Optimized Hydrophobic Interactions and Hydrogen Bonding at the Target-Ligand Interface Leads the Pathways of Drug-Designing

Structure-based Drug Metabolism Predictions for Drug Design

(2009) Hao Sun et al.   Chemical Biology & Drug Design

Engineering a Ubiquitin Ligase Reveals Conformational Flexibility Required for Ubiquitin Transfer

(2009) Shu-Bing Qian et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

C−X···H Contacts in Biomolecular Systems: How They Contribute to Protein−Ligand Binding Affinity

(2009) Yunxiang Lu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Binding of Small-Molecule Ligands to Proteins: “What You See” Is Not Always “What You Get”

(2009) David L. Mobley et al.   STRUCTURE

Accurate Prediction of Peptide Binding Sites on Protein Surfaces

(2009) Evangelia Petsalaki et al.   PLoS Computational Biology

Strong and weak hydrogen bonds in protein-ligand complexes of kinases: a comparative study

(2008) Sunil K. Panigrahi   AMINO ACIDS

Recent Advances in Classical and Non-Classical Antifolates as Antitumor and Antiopportunistic Infection Agents: Part II

(2008) Aleem Gangjee et al.   Anti-Cancer Agents in Medicinal Chemistry

Designing transient binding drugs: A new concept for drug discovery

(2008) Sten Ohlson   DRUG DISCOVERY TODAY

Synthesis, biological evaluation and docking studies of 4-amino substituted 1H-pyrazolo[3,4-d]pyrimidines

(2008) Silvia Schenone et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Protein–protein interactions as targets for small-molecule therapeutics in cancer

(2008) Alex W. White et al.   EXPERT REVIEWS IN MOLECULAR MEDICINE

Potent HIV-1 protease inhibitors incorporating meso-bicyclic urethanes as P2-ligands: structure-based design, synthesis, biological evaluation and protein–ligand X-ray studies

(2008) Arun K. Ghosh et al.   ORGANIC & BIOMOLECULAR CHEMISTRY

Dual-fluorophore quantitative high-throughput screen for inhibitors of BRCT–phosphoprotein interaction

(2007) Anton Simeonov et al.   ANALYTICAL BIOCHEMISTRY