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Computational Enzyme Stabilization Can Affect Folding Energy Landscapes and Lead to Catalytically Enhanced Domain-Swapped Dimers | ACS Catalysis
IJMS | Free Full-Text | Exploration of the Shared Molecular Mechanisms between COVID-19 and Neurodegenerative Diseases through Bioinformatic Analysis
In Silico Modeling and Scoring of PROTAC-Mediated Ternary Complex Poses | Journal of Medicinal Chemistry
The CopC Family: Structural and Bioinformatic Insights into a Diverse Group of Periplasmic Copper Binding Proteins | Biochemistry
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A Step toward the Quantification of Noncovalent Interactions in Large Biological Systems: The Independent Gradient Model-Extremely Localized Molecular Orbital Approach | Journal of Chemical Information and Modeling
Controlling Allosteric Networks in Proteins | Chemical Reviews
Refactoring the Embden–Meyerhof–Parnas Pathway as a Whole of Portable GlucoBricks for Implantation of Glycolytic Modules in Gram-Negative Bacteria | ACS Synthetic Biology
Role of Structural Dynamics in Selectivity and Mechanism of Non-heme Fe(II) and 2-Oxoglutarate-Dependent Oxygenases Involved in DNA Repair | ACS Central Science
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Batteries | Free Full-Text | Smart Battery Management Technology in Electric Vehicle Applications: Analytical and Technical Assessment toward Emerging Future Directions
High-Flux Thin Film Composite PIM-1 Membranes for Butanol Recovery: Experimental Study and Process Simulations | ACS Applied Materials & Interfaces
Structural Role of the First Four Transmembrane Helices in ZntA, a P1B-Type ATPase from Escherichia coli | Biochemistry
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Application of Ionic Liquids to Energy Storage and Conversion Materials and Devices | Chemical Reviews
Antibiotics | Free Full-Text | Computational Design of Inhibitors Targeting the Catalytic β Subunit of Escherichia coli FOF1-ATP Synthase
Decoding the Identification Mechanism of an SAM-III Riboswitch on Ligands through Multiple Independent Gaussian-Accelerated Molecular Dynamics Simulations | Journal of Chemical Information and Modeling
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Peptidase Activation by a Leader Peptide-Bound RiPP Recognition Element | Biochemistry
Cross-tissue, single-cell stromal atlas identifies shared pathological fibroblast phenotypes in four chronic inflammatory diseases - ScienceDirect
Combining Machine Learning and Molecular Dynamics to Predict P-Glycoprotein Substrates | Journal of Chemical Information and Modeling
A toxin-deformation dependent inhibition mechanism in the T7SS toxin-antitoxin system of Gram-positive bacteria | Nature Communications
Mechanistic Insights into Substrate Positioning That Distinguish Non-heme Fe(II)/α-Ketoglutarate-Dependent Halogenases and Hydroxylases | ACS Catalysis
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Applied Sciences | Free Full-Text | Using Artificial Intelligence for Space Challenges: A Survey
