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Molecular dynamics
30
Dynamical characteristics
28
Solvation
18
Hydrogen bonds
12
Molecules
12
Molecular dynamics simulations
10
Solvation shell
10
Water molecule
10
Acetone
8
Acetone molecules
8
Hydrophobicity
8
Proton transfer
8
Relative concentration
8
Solvation response
8
chemistry
8
Ambient conditions
6
Bulk-like
6
Diffusive motions
6
Dynamics
6
Hydrophilicity
6
Hydrophobic cavities
6
Molecular Dynamics Simulation
6
Molecular dynamics techniques
6
Polarization fluctuations
6
Pore wall
6
Quantum electronics
6
Quantum fluctuation
6
Silica
6
article
6
molecular dynamics
6
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