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Molecular structure

The Structural Basis of Erwinia rhapontici Isomaltulose Synthase

Zheng Xu, Sha Li, [ ... ], Jiahai Zhou

Crystal Structures of Human CaMKIα Reveal Insights into the Regulation Mechanism of CaMKI

Manwu Zha, Chen Zhong, [ ... ], Jianping Ding

Inference of Structure Ensembles of Flexible Biomolecules from Sparse, Averaged Data

Simon Olsson, Jes Frellsen, [ ... ], Thomas Hamelryck

The Role of Water in Activation Mechanism of Human N-Formyl Peptide Receptor 1 (FPR1) Based on Molecular Dynamics Simulations

Shuguang Yuan, Umesh Ghoshdastider, [ ... ], Slawomir Filipek

The Potential Utility of Predicted One Bond Carbon-Proton Coupling Constants in the Structure Elucidation of Small Organic Molecules by NMR Spectroscopy

Chandrasekhar Venkata, Mark J. Forster, Peter W. A. Howe, Christoph Steinbeck

Crystal Structure of the Cysteine Desulfurase DndA from Streptomyces lividans Which Is Involved in DNA Phosphorothioation

Fukun Chen, Zhenyi Zhang, [ ... ], Geng Wu

Inhibition of Paracoccidioides lutzii Pb01 Isocitrate Lyase by the Natural Compound Argentilactone and Its Semi-Synthetic Derivatives

Renata Silva do Prado, Ricardo Justino Alves, [ ... ], Maristela Pereira

The Cysteine-Rich Protein Thimet Oligopeptidase as a Model of the Structural Requirements for S-glutathiolation and Oxidative Oligomerization

Alberto Malvezzi, Patrícia M. Higa, [ ... ], Marilene Demasi

Molecular Structure of Amyloid Fibrils Controls the Relationship between Fibrillar Size and Toxicity

Young Jin Lee, Regina Savtchenko, [ ... ], Ilia V. Baskakov

The Influence of 150-Cavity Binders on the Dynamics of Influenza A Neuraminidases as Revealed by Molecular Dynamics Simulations and Combined Clustering

Kyle T. Greenway, Eric B. LeGresley, B. Mario Pinto

Ensemble learning method for the prediction of new bioactive molecules

Lateefat Temitope Afolabi, Faisal Saeed, Haslinda Hashim, Olutomilayo Olayemi Petinrin

Modeling the Structure of RNA Molecules with Small-Angle X-Ray Scattering Data

Michal Jan Gajda, Denise Martinez Zapien, Emiko Uchikawa, Anne-Catherine Dock-Bregeon

Disruption of Hydrogen Bonds between Major Histocompatibility Complex Class II and the Peptide N-Terminus Is Not Sufficient to Form a Human Leukocyte Antigen-DM Receptive State of Major Histocompatibility Complex Class II

Monika-Sarah E. D. Schulze, Anne-Kathrin Anders, Dhruv K. Sethi, Melissa J. Call

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