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Keyword [solvation]
Result: 1 - 19 | Page: 1 of 1
1. Theoretical Studies On NMR Spectroscopic Parameters
2. Computer Simulation Of Binding Free Energy And Conformational Changes For Bio-Macromolecule
3. The Study Of MPI-MS And Ab Initio Calculation Of Alcohol Clusters
4. Quantum-chemical Studies Of Solvent Effect
5. The Research On Surface-Based Model For Predicting Solvation Free Energy
6. Applications Of Multi-scale Simulation On Life Science And Material
7. Computing Electrostatic Potential For An Ion-channel Model
8. Fragment-based Quantum Mechanical Calculation Of Protein-protein Binding Affinities
9. Assessment Of Protein Structure Models Based On Generalized Solvation Free Energy Theory
10. Solvation free energies from a coupled reference interaction site model/simulation approach
11. Femtosecond time-resolved spectroscopy of anionic systems: Dynamics of mesoscopic solvation and gas-phase organic reactions
12. Differential geometry based multiscale modeling of solvation
13. Implementation and application of a GCOSMO solvation model within DeFT and a hybrid DeFT/Mopac Monte Carlo algorithm
14. Femtosecond time-resolved spectroscopy of gas-phase anions: Electron solvation and chromophore dynamics
15. Solvation and interactions in aqueous, organic, and biomolecular systems at nanoscale interfaces
16. Delaunay-laguerre geometry for macromolecular modeling and implicit solvation
17. Quantum Mechanics And Molecular Mechanics To Study The Solvation Free Energy And The Catalytic Effect Of Enzymes
18. Studies Of Electronic Structures And Micro-solvation Of SO3- And HSO3- In The Atmospheric Aerosols
19. The Molecular Simulation Of The Effects Of Ionic Liquids On The Structural Stability Of Biological Macromolecules
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