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Electrostatic bonding

Insight on Mutation-Induced Resistance from Molecular Dynamics Simulations of the Native and Mutated CSF-1R and KIT

Priscila Da Silva Figueiredo Celestino Gomes, Isaure Chauvot De Beauchêne, Nicolas Panel, Sophie Lopez, Paulo De Sepulveda, Pedro Geraldo Pascutti, Eric Solary, Luba Tchertanov

published 28 Jul 2016

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Striking HIV-1 Entry by Targeting HIV-1 gp41. But, Where Should We Target?

Cátia Teixeira, Florent Barbault, Thierry Couesnon, José R. B. Gomes, Paula Gomes, François Maurel

published 19 Jan 2016

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A Spectroscopic Approach to Investigate the Molecular Interactions between the Newly Approved Irreversible ErbB blocker "Afatinib" and Bovine Serum Albumin

Amer M. Alanazi, Ali Saber Abdelhameed

published 11 Jan 2016

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Engineering of Immunoglobulin Fc Heterodimers Using Yeast Surface-Displayed Combinatorial Fc Library Screening

Hye-Ji Choi, Ye-Jin Kim, Dong-Ki Choi, Yong-Sung Kim

published 16 Dec 2015

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A Simple Method for Discovering Druggable, Specific Glycosaminoglycan-Protein Systems. Elucidation of Key Principles from Heparin/Heparan Sulfate-Binding Proteins

Aurijit Sarkar, Umesh R. Desai

published 21 Oct 2015

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DARC 2.0: Improved Docking and Virtual Screening at Protein Interaction Sites

Ragul Gowthaman, Sergey Lyskov, John Karanicolas

published 16 Jul 2015

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Uncovering Molecular Bases Underlying Bone Morphogenetic Protein Receptor Inhibitor Selectivity

Abdelaziz Alsamarah, Alecander E. LaCuran, Peter Oelschlaeger, Jijun Hao, Yun Luo

published 02 Jul 2015

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Cordycepin and N⁶-(2-Hydroxyethyl)-Adenosine from Cordyceps pruinosa and Their Interaction with Human Serum Albumin

Zebin Meng, Jichuan Kang, Tingchi Wen, Bangxing Lei, Kevin David Hyde

published 26 Mar 2015

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TBI Server: A Web Server for Predicting Ion Effects in RNA Folding

Yuhong Zhu, Zhaojian He, Shi-Jie Chen

published 23 Mar 2015

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WW Domains of the Yes-Kinase-Associated-Protein (YAP) Transcriptional Regulator Behave as Independent Units with Different Binding Preferences for PPxY Motif-Containing Ligands

Manuel Iglesias-Bexiga, Francisco Castillo, Eva S. Cobos, Tsutomu Oka, Marius Sudol, Irene Luque

published 21 Jan 2015

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Molecular Dynamics Studies of the Inhibitor C34 Binding to the Wild-Type and Mutant HIV-1 gp41: Inhibitory and Drug Resistant Mechanism

Xueting Ma, Jianjun Tan, Min Su, Chunhua Li, Xiaoyi Zhang, Cunxin Wang

published 13 Nov 2014

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How Structure Defines Affinity in Protein-Protein Interactions

Ariel Erijman, Eran Rosenthal, Julia M. Shifman

published 16 Oct 2014

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The Effect of Macromolecular Crowding on the Electrostatic Component of Barnase–Barstar Binding: A Computational, Implicit Solvent-Based Study

Helena W. Qi, Priyanka Nakka, Connie Chen, Mala L. Radhakrishnan

published 10 Jun 2014

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