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Electrostatic bonding

Isomeric Mono-, Di-, and Tri-Bromobenzo-1H-Triazoles as Inhibitors of Human Protein Kinase CK2α

Romualda Wąsik, Patrycja Wińska, Jarosław Poznański, David Shugar

published 14 Nov 2012

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Validation of Drug-Like Inhibitors against Mycobacterium Tuberculosis L-Aspartate α-Decarboxylase Using Nuclear Magnetic Resonance (¹H NMR)

Reetu Sharma, Mara Florea, Werner M. Nau, Kunchithapadam Swaminathan

published 28 Sep 2012

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Atomistic Mechanism of MicroRNA Translation Upregulation via Molecular Dynamics Simulations

Wei Ye, Fang Qin, Jian Zhang, Ray Luo, Hai-Feng Chen

published 27 Aug 2012

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Proteome Adaptation to High Temperatures in the Ectothermic Hydrothermal Vent Pompeii Worm

Didier Jollivet, Jean Mary, Nicolas Gagnière, Arnaud Tanguy, Eric Fontanillas, Isabelle Boutet, Stéphane Hourdez, Béatrice Segurens, Jean Weissenbach, Olivier Poch, Odile Lecompte

published 10 Feb 2012

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

Nagakumar Bharatham, Seung-Wook Chi, Ho Sup Yoon

published 19 Oct 2011

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Molecular Basis of Ligand Dissociation in β-Adrenergic Receptors

Angel González, Tomas Perez-Acle, Leonardo Pardo, Xavier Deupi

published 07 Sep 2011

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Probing the Interaction of the Diarylquinoline TMC207 with Its Target Mycobacterial ATP Synthase

Anna C. Haagsma, Ioana Podasca, Anil Koul, Koen Andries, Jerome Guillemont, Holger Lill, Dirk Bald

published 17 Aug 2011

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Molecular Recognition of H3/H4 Histone Tails by the Tudor Domains of JMJD2A: A Comparative Molecular Dynamics Simulations Study

Musa Ozboyaci, Attila Gursoy, Burak Erman, Ozlem Keskin

published 25 Mar 2011

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Predictions of Hot Spot Residues at Protein-Protein Interfaces Using Support Vector Machines

Stefano Lise, Daniel Buchan, Massimiliano Pontil, David T. Jones

published 28 Feb 2011

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Towards Universal Structure-Based Prediction of Class II MHC Epitopes for Diverse Allotypes

Andrew J. Bordner

published 20 Dec 2010

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EB1 Recognizes the Nucleotide State of Tubulin in the Microtubule Lattice

Marija Zanic, Jeffrey H. Stear, Anthony A. Hyman, Jonathon Howard

published 23 Oct 2009

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Investigation of Atomic Level Patterns in Protein—Small Ligand Interactions

Ke Chen, Lukasz Kurgan

published 16 Feb 2009

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Variations in the Electrostatic Landscape of Class II Human Leukocyte Antigen Molecule Induced by Modifications in the Myelin Basic Protein Peptide: A Theoretical Approach

William A. Agudelo, Johan F. Galindo, Marysol Ortiz, José L. Villaveces, Edgar E. Daza, Manuel E. Patarroyo

published 09 Jan 2009

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