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Large-scale molecular dynamics simulations of nano-structured materials
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Animal to human scaling and pharmacokinetic/pharmacodynamic modeling of anticancer drugs
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Molecular- and continuum-scale simulation of single- and two-phase flow of CO₂ and H₂O in mixed-layer clays and a heterogeneous sandstone
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Molecular dynamics simulations of nanostructures
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Molecular aspects of skin early morphogenesis
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Laser manipulation of atomic and molecular flows
Nanomaterials under extreme environments: a study of structural and dynamic properties using reactive molecular dynamics simulations
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Marine bacterioplankton biogeography over short to medium spatio-temporal scales
Assessing molecular heterogeneity in clinical isolates of  Aspergillus fumigatus
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Computational methods for fluorescence molecular tomography
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Multi-scale biomimetic structure fabrication based on immersed surface accumulation
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Inference for stochastic models of molecular data
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The complex genetic and molecular basis of oxidative stress tolerance
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Molecular and genomic studies of sex determination in Drosophila
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Organic solar cells: molecular electronic processes and device development
High throughput computational framework for synthesis and accelerated discovery of dielectric polymer materials using polarizable reactive molecular dynamics and graph neural networks
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Molecular dynamics simulations of lipid bilayers in megavolt per meter electric fields
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Molecular orientation from sum frequency generation spectroscopy: case study of water and methyl vibrations
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Electrical and electrochemical properties of molecular and conducting polymer coated nanoscale field effect transistors
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Molecular simulations of water and monovalent ion dynamics in the electroporation of phospholipid bilayers
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KcsA: mutational analysis of ion selectivity with molecular dynamics
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Personalized breast cancer management using 5-fluorouracil and related biomarkers: a molecular biology and business perspective
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Neural network for molecular dynamics simulation and design of 2D materials
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Development of carbon molecular-sieve membranes with tunable properties: modification of the pore size and surface affinity
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Shifting topology of stem cells and molecular expression during feather regenerative cycling
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