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Hydrogen bonding

Simulating Molecular Mechanisms of the MDM2-Mediated Regulatory Interactions: A Conformational Selection Model of the MDM2 Lid Dynamics

Gennady M. Verkhivker

Ipomoelin, a Jacalin-Related Lectin with a Compact Tetrameric Association and Versatile Carbohydrate Binding Properties Regulated by Its N Terminus

Wei-Chieh Chang, Kai-Lun Liu, [ ... ], Yi-Sheng Cheng

Energetics of Ortho-7 (Oxime Drug) Translocation through the Active-Site Gorge of Tabun Conjugated Acetylcholinesterase

Vivek Sinha, Bishwajit Ganguly, Tusar Bandyopadhyay

Singlet Oxygen Reactions with Flavonoids. A Theoretical – Experimental Study

Javier Morales, Germán Günther, Antonio L. Zanocco, Else Lemp

Small Molecule Inhibitors of the LEDGF Site of Human Immunodeficiency Virus Integrase Identified by Fragment Screening and Structure Based Design

Thomas S. Peat, David I. Rhodes, [ ... ], John J. Deadman

A Study on the Effect of Surface Lysine to Arginine Mutagenesis on Protein Stability and Structure Using Green Fluorescent Protein

Sriram Sokalingam, Govindan Raghunathan, Nagasundarapandian Soundrarajan, Sun-Gu Lee

Structural Insights into the Effector – Immunity System Tse1/Tsi1 from Pseudomonas aeruginosa

Juliane Benz, Christina Sendlmeier, Thomas R. M. Barends, Anton Meinhart

Small Molecules Targeted to a Non-Catalytic “RVxF” Binding Site of Protein Phosphatase-1 Inhibit HIV-1

Tatiana Ammosova, Maxim Platonov, [ ... ], Sergei Nekhai

Cold-Induced Changes in the Protein Ubiquitin

Min-Kyu Cho, ShengQi Xiang, [ ... ], Markus Zweckstetter

Water in Crystalline Fibers of Dihydrate β-Chitin Results in Unexpected Absence of Intramolecular Hydrogen Bonding

Daisuke Sawada, Yoshiharu Nishiyama, [ ... ], Masahisa Wada

Application of Consensus Scoring and Principal Component Analysis for Virtual Screening against β-Secretase (BACE-1)

Shu Liu, Rao Fu, Li-Hua Zhou, Sheng-Ping Chen

Synthesis and Biological Evaluation of Phenanthrenes as Cytotoxic Agents with Pharmacophore Modeling and ChemGPS-NP Prediction as Topo II Inhibitors

Chia-Lin Lee, Ying-Ting Lin, [ ... ], Yang-Chang Wu

Analytic Markovian Rates for Generalized Protein Structure Evolution

Ivan Coluzza, James T. MacDonald, [ ... ], Richard A. Goldstein

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