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Publications by Mingyuan Xu
A Force Balanced Fragmentation Method for Ab Initio Molecular Dynamic Simulation of Protein
Frontiers in Chemistry
Chemistry
A CMOS Input Buffer With Linearization Technique for High-Speed a/D
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Ligand-Protein Interactions: A Hybrid Ab Initio/Molecular Mechanics Computational Study
Ligand-Protein Interactions: A Hybrid Ab Initio/Molecular Mechanics Computational Study
Unconventional Molecular Replacement Approaches for Ab Initio Phasing of Transmembrane Helical Protein Targets
Acta Crystallographica Section A: Foundations and Advances
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An Ab Initio Parametrized Interatomic Force Field for Silica
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Conformational and Dynamic Properties of Poly(ethylene Oxide) in BMIM+BF4: A Microsecond Computer Simulation Study Using Ab Initio Force Fields
Action-Derived Ab Initio Molecular Dynamics
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Time-Reversible Ab Initio Molecular Dynamics
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Reciprocity Theorems and Pseudoelectric Fields for Ab Initio Force Calculations
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Intersystem Crossing-Branched Excited-State Intramolecular Proton Transfer for O-Nitrophenol: An Ab Initio On-The-Fly Nonadiabatic Molecular Dynamic Simulation
Scientific Reports
Multidisciplinary