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Atomic structure

Device performances analysis of p-type doped silicene-based field effect transistor using SPICE-compatible model

Mu Wen Chuan, Munawar Agus Riyadi, [ ... ], Michael Loong Peng Tan

Data-driven coarse graining of large biomolecular structures

Yi-Ling Chen, Michael Habeck

Atomistic modeling of alternating access of a mitochondrial ADP/ATP membrane transporter with molecular simulations

Koichi Tamura, Shigehiko Hayashi

Identification and characterization of a neutralizing monoclonal antibody that provides complete protection against Yersinia pestis

Weicen Liu, Jun Ren, [ ... ], Wei Chen

The Five-To-Six-Coordination Transition of Ferric Human Serum Heme-Albumin Is Allosterically-Modulated by Ibuprofen and Warfarin: A Combined XAS and MD Study

Carlo Meneghini, Loris Leboffe, [ ... ], Settimio Mobilio

High-Quality NMR Structure of Human Anti-Apoptotic Protein Domain Mcl-1(171-327) for Cancer Drug Design

Gaohua Liu, Leszek Poppe, [ ... ], Thomas Szyperski

Distant Homology Modeling of LCAT and Its Validation through In Silico Targeting and In Vitro and In Vivo Assays

Cristina Sensi, Sara Simonelli, [ ... ], Ivano Eberini

NMR Structure of Temporin-1 Ta in Lipopolysaccharide Micelles: Mechanistic Insight into Inactivation by Outer Membrane

Rathi Saravanan, Mangesh Joshi, [ ... ], Surajit Bhattacharjya

Head-Head Interactions of Resting Myosin Crossbridges in Intact Frog Skeletal Muscles, Revealed by Synchrotron X-Ray Fiber Diffraction

Kanji Oshima, Yasunobu Sugimoto, Thomas C. Irving, Katsuzo Wakabayashi

FRET-Based Localization of Fluorescent Protein Insertions Within the Ryanodine Receptor Type 1

Shweta A. Raina, Jeffrey Tsai, Montserrat Samsó, James D. Fessenden

Recognition of Interaction Interface Residues in Low-Resolution Structures of Protein Assemblies Solely from the Positions of Cα Atoms

Rupali A. Gadkari, Deepthi Varughese, N. Srinivasan

FitEM2EM—Tools for Low Resolution Study of Macromolecular Assembly and Dynamics

Ziv Frankenstein, Joseph Sperling, Ruth Sperling, Miriam Eisenstein

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