Diffusion mechanism and adsorbed-phase classification-molecular simulation insights from Lennard-Jones fluid on MOFs. [PDF]
Chen H+6 more
europepmc +1 more source
RDF graph pair profile dataset for the data linking community. [PDF]
Conde Salazar R+2 more
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Structural basis of directionality control in large serine integrases
Shin H+5 more
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Enhanced Ion Solvation and Conductivity in Lithium-Ion Electrolytes via Tailored EMC-TMS Solvent Mixtures: A Molecular Dynamics Study. [PDF]
Kasemchainan J+2 more
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Life Cycle Assessment of RDF Power Generation in Northern Ishikawa Prefecture
Motoko Yamanari, Sohei SHIMADA
openalex +2 more sources
Molecular Dynamics Simulation of Structural Assembly and Hydration of Hyaluronic Acid in Salt Aqueous Buffer. [PDF]
Vasudevan S+3 more
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Bacterial clustering amplifies the reshaping of eutrophic plumes around marine particles: A hybrid data-driven model. [PDF]
Kapellos GE+4 more
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A Picture is Worth a Thousand Timesteps: Excess Entropy Scaling for Rapid Estimation of Diffusion Coefficients in Molecular-Dynamics Simulations of Fluids. [PDF]
Ghaffarizadeh SA, Wang GJ.
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Strained Mechanical and Fracture Analyses of Armchair-Chiral-Zigzag-Based Carbon Nanotubes Using Molecular Dynamics Simulations. [PDF]
Zahra AT+8 more
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