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Molecular structure

Plasma Membrane Abundance of Human Aquaporin 5 Is Dynamically Regulated by Multiple Pathways

Philip Kitchen, Fredrik Öberg, Jennie Sjöhamn, Kristina Hedfalk, Roslyn M. Bill, Alex C. Conner, Matthew T. Conner, Susanna Törnroth-Horsefield

published 16 Nov 2015

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Crystal Structure of DIM-1, an Acquired Subclass B1 Metallo-β-Lactamase from Pseudomonas stutzeri

Michael P. S. Booth, Magda Kosmopoulou, Laurent Poirel, Patrice Nordmann, James Spencer

published 09 Oct 2015

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A Framework to Simplify Combined Sampling Strategies in Rosetta

Justin R. Porter, Brian D. Weitzner, Oliver F. Lange

published 18 Sep 2015

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Identification of Novel Aldose Reductase Inhibitors from Spices: A Molecular Docking and Simulation Study

Priya Antony, Ranjit Vijayan

published 18 Sep 2015

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GARN: Sampling RNA 3D Structure Space with Game Theory and Knowledge-Based Scoring Strategies

Mélanie Boudard, Julie Bernauer, Dominique Barth, Johanne Cohen, Alain Denise

published 27 Aug 2015

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Liquid Chromatography Electrospray Ionization Tandem Mass Spectrometric (LC/ESI-MS/MS) Study for the Identification and Characterization of In Vivo Metabolites of Cisplatin in Rat Kidney Cancer Tissues: Online Hydrogen/Deuterium (H/D) Exchange Study

Raju Bandu, Hyun Soo Ahn, Joon Won Lee, Yong Woo Kim, Seon Hee Choi, Hak Jin Kim, Kwang Pyo Kim

published 05 Aug 2015

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Computational Structure-Based De Novo Design of Hypothetical Inhibitors against the Anti- Inflammatory Target COX-2

Jaspreet Kaur Dhanjal, Anith Kumar Sreenidhi, Khushboo Bafna, Shashank Prakash Katiyar, Sukriti Goyal, Abhinav Grover, Durai Sundar

published 04 Aug 2015

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Chemical Characterization of N-Linked Oligosaccharide As the Antigen Epitope Recognized by an Anti-Sperm Auto-Monoclonal Antibody, Ts4

Hiroshi Yoshitake, Noritaka Hashii, Nana Kawasaki, Shuichiro Endo, Kenji Takamori, Akiko Hasegawa, Hiroshi Fujiwara, Yoshihiko Araki

published 29 Jul 2015

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Fully Flexible Docking of Medium Sized Ligand Libraries with RosettaLigand

Samuel DeLuca, Karen Khar, Jens Meiler

published 24 Jul 2015

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Aqueous, Unfolded OmpA Forms Amyloid-Like Fibrils upon Self-Association

Emily J. Danoff, Karen G. Fleming

published 21 Jul 2015

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Structural Basis for the Inhibition of a Phospholipase A₂-Like Toxin by Caffeic and Aristolochic Acids

Carlos A. H. Fernandes, Fábio Florença Cardoso, Walter G. L. Cavalcante, Andreimar M. Soares, Maeli Dal-Pai, Marcia Gallacci, Marcos R. M. Fontes

published 20 Jul 2015

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Complete Structure of an Epithelial Keratin Dimer: Implications for Intermediate Filament Assembly

David J. Bray, Tiffany R. Walsh, Massimo G. Noro, Rebecca Notman

published 16 Jul 2015

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All-Purpose Containers? Lipid-Binding Protein – Drug Interactions

Tiziana Beringhelli, Elisabetta Gianazza, Daniela Maggioni, Sandra Scanu, Chiara Parravicini, Cristina Sensi, Hugo L. Monaco, Ivano Eberini

published 13 Jul 2015

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