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Hydrogen bonding

TCRep 3D: An Automated In Silico Approach to Study the Structural Properties of TCR Repertoires

Antoine Leimgruber, Mathias Ferber, [ ... ], Olivier Michielin

Altered Antibiotic Transport in OmpC Mutants Isolated from a Series of Clinical Strains of Multi-Drug Resistant E. coli

Hubing Lou, Min Chen, [ ... ], James H. Naismith

Novel Allosteric Sites on Ras for Lead Generation

Barry J. Grant, Suryani Lukman, [ ... ], Alemayehu A. Gorfe

Tyrosine Deprotonation and Associated Hydrogen Bond Rearrangements in a Photosynthetic Reaction Center

Hiroshi Ishikita

Structural Insight of Dopamine β-Hydroxylase, a Drug Target for Complex Traits, and Functional Significance of Exonic Single Nucleotide Polymorphisms

Abhijeet Kapoor, Manish Shandilya, Suman Kundu

Molecular Basis of Bcl-X_L-p53 Interaction: Insights from Molecular Dynamics Simulations

Nagakumar Bharatham, Seung-Wook Chi, Ho Sup Yoon

The Atypical Stimulant and Nootropic Modafinil Interacts with the Dopamine Transporter in a Different Manner than Classical Cocaine-Like Inhibitors

Kyle C. Schmitt, Maarten E. A. Reith

Conservation of the Human Integrin-Type Beta-Propeller Domain in Bacteria

Bhanupratap Chouhan, Alexander Denesyuk, [ ... ], Konstantin Denessiouk

Elucidation of the Glucose Transport Pathway in Glucose Transporter 4 via Steered Molecular Dynamics Simulations

Aswathy Sheena, Suma S. Mohan, Nidhina Pachakkil A. Haridas, Gopalakrishnapillai Anilkumar

Insights into the Complex Formed by Matrix Metalloproteinase-2 and Alloxan Inhibitors: Molecular Dynamics Simulations and Free Energy Calculations

Ilenia Giangreco, Gianluca Lattanzi, [ ... ], Angelo Carotti

How to Change the Oligomeric State of a Circular Protein Assembly: Switch from 11-Subunit to 12-Subunit TRAP Suggests a General Mechanism

Chao-Sheng Chen, Callum Smits, [ ... ], Alfred A. Antson

HF-EPR, Raman, UV/VIS Light Spectroscopic, and DFT Studies of the Ribonucleotide Reductase R2 Tyrosyl Radical from Epstein-Barr Virus

Ane B. Tomter, Giorgio Zoppellaro, [ ... ], K. Kristoffer Andersson

Structural Insights into the Mechanism of Protein O-Fucosylation

Erandi Lira-Navarrete, Jessika Valero-González, [ ... ], Ramon Hurtado-Guerrero

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