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Molecular structure

Optimal Identification of Semi-Rigid Domains in Macromolecules from Molecular Dynamics Simulation

Stefan Bernhard, Frank Noé

published 13 May 2010

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Limitations of Ab Initio Predictions of Peptide Binding to MHC Class II Molecules

Hao Zhang, Peng Wang, Nikitas Papangelopoulos, Ying Xu, Alessandro Sette, Philip E. Bourne, Ole Lund, Julia Ponomarenko, Morten Nielsen, Bjoern Peters

published 17 Feb 2010

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How Cholesterol Constrains Glycolipid Conformation for Optimal Recognition of Alzheimer's β Amyloid Peptide (Aβ_1-40)

Nouara Yahi, Anaïs Aulas, Jacques Fantini

published 05 Feb 2010

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Predicting the Antigenic Structure of the Pandemic (H1N1) 2009 Influenza Virus Hemagglutinin

Manabu Igarashi, Kimihito Ito, Reiko Yoshida, Daisuke Tomabechi, Hiroshi Kida, Ayato Takada

published 01 Jan 2010

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Generating Triangulated Macromolecular Surfaces by Euclidean Distance Transform

Dong Xu, Yang Zhang

published 02 Dec 2009

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Structure of an Odorant-Binding Protein from the Mosquito Aedes aegypti Suggests a Binding Pocket Covered by a pH-Sensitive “Lid”

Ney Ribeiro Leite, Renata Krogh, Wei Xu, Yuko Ishida, Jorge Iulek, Walter S. Leal, Glaucius Oliva

published 26 Nov 2009

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Catalytic Water Co-Existing with a Product Peptide in the Active Site of HIV-1 Protease Revealed by X-Ray Structure Analysis

Vishal Prashar, Subhash Bihani, Amit Das, Jean-Luc Ferrer, Madhusoodan Hosur

published 17 Nov 2009

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Isolation of Cell Nuclei Using Inert Macromolecules to Mimic the Crowded Cytoplasm

Ronald Hancock, Yasmina Hadj-Sahraoui

published 23 Oct 2009

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Crystal Structure of the PIM2 Kinase in Complex with an Organoruthenium Inhibitor

Alex N. Bullock, Santina Russo, Ann Amos, Nicholas Pagano, Howard Bregman, Judit É. Debreczeni, Wen Hwa Lee, Frank von Delft, Eric Meggers, Stefan Knapp

published 20 Oct 2009

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Hierarchical Structure Controls Nanomechanical Properties of Vimentin Intermediate Filaments

Zhao Qin, Laurent Kreplak, Markus J. Buehler

published 06 Oct 2009

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Comparative Sequence and Structural Analyses of G-Protein-Coupled Receptor Crystal Structures and Implications for Molecular Models

Catherine L. Worth, Gunnar Kleinau, Gerd Krause

published 16 Sep 2009

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Decorin Core Protein (Decoron) Shape Complements Collagen Fibril Surface Structure and Mediates Its Binding

Joseph P. R. O. Orgel, Aya Eid, Olga Antipova, Jordi Bella, John E. Scott

published 15 Sep 2009

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Glutamic Acid Decarboxylase-Derived Epitopes with Specific Domains Expand CD4⁺CD25⁺ Regulatory T Cells

Guojiang Chen, Gencheng Han, Jiannan Feng, Jianan Wang, Renxi Wang, Ruonan Xu, Beifen Shen, Jiahua Qian, Yan Li

published 13 Sep 2009

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