Featured Research

Mechanism of the Association between Na+ Binding and Conformations at the Intracellular Gate in Neurotransmitter:Sodium Symporters
Mechanism of the Association between Na+ Binding and Conformations at the Intracellular Gate in Neurotransmitter:Sodium Symporters

Sebastian Stolzenberg, Matthias Quick, Chunfeng Zhao, Kamil Gotfryd, George Khelashvili, Ulrik Gether, Claus J. Loland, Jonathan A. Javitch, Sergei Noskov, Harel Weinstein, Lei Shi: J. Biol. Chem. (2015) 290, 13992-14003

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Modeling Protein–Micelle Systems in Implicit Water
Modeling Protein–Micelle Systems in Implicit Water

Rodney E. Versace, Themis Lazaridis: J. Phys. Chem. B (2015) 119, 8037-8047

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Noncanonical Secondary Structure Stabilizes Mitochondrial tRNASer(UCN) by Reducing the Entropic Cost of Tertiary Folding
Noncanonical Secondary Structure Stabilizes Mitochondrial tRNASer(UCN) by Reducing the Entropic Cost of Tertiary Folding

Anthony M. Mustoe, Xin Liu, Paul J. Lin, Hashim M. Al-Hashimi, Carol A. Fierke, Charles L. Brooks III: J. Am. Chem. Soc. (2015) 137, 3592-3599

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Discovery of CREBBP Bromodomain Inhibitors by High-Throughput Docking and Hit Optimization Guided by Molecular Dynamics
Discovery of CREBBP Bromodomain Inhibitors by High-Throughput Docking and Hit Optimization Guided by Molecular Dynamics

Min Xu, Andrea Unzue, Jing Dong, Dimitrios Spiliotopoulos, Cristina Nevado, Amedeo Caflisch: J. Med. Chem. (2015) ASAP

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Principal Component Analysis reveals correlation of cavities evolution and functional motions in proteins
Principal Component Analysis reveals correlation of cavities evolution and functional motions in proteins

Nathan Desdouits, Michael Nilges, Arnaud Blondel: J. Mol. Graph. Model. (2015) 55, 13-24

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Dynamics of the BH3-Only Protein Binding Interface of Bcl-xL
Dynamics of the BH3-Only Protein Binding Interface of Bcl-xL

Xiaorong Liu, Alex Beugelsdijk, Jianhan Chen: Biophys. J. (2015) 109, 1049-1057

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Reproducing kernel potential energy surfaces in biomolecular simulations: Nitric oxide binding to myoglobin
Reproducing kernel potential energy surfaces in biomolecular simulations: Nitric oxide binding to myoglobin

Maksym Solovlov and Markus Meuwly: J. Chem. Phys. 143, 105103 (2015)

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