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Keyword [QM/MM method]
Result: 1 - 19 | Page: 1 of 1
1. Theoretical Study Of Copper And Zinc Ions With A¦Â Peptide Bonding Mode
2. Theoretical Studies On The Catalytic Mechanisms Of Several Metal-containing Enzymes And Glycosidases
3. Theoretical Study Of Organophosphorus Toxicology And Organochlorine Degradation In Enzyme Systems
4. Studies Of The Catalytic Mechanisms Of Methyltransferase, Peptidylarginine Deiminase And Acetolactate Decarboxylase
5. Water-induced Transition State Of The OH-+CO2 Reaction In Aqueous Solution With Multi-Level QM/MM Method
6. Theoretical Studies On The Mechanisms Of Several Enzymes
7. Theoretical Study On The Enzymatic Transformation And Atmospheric Degradation Mechanisms Of Typical Environmental Organic Pollutants
8. Combination QM/MM Method To Calculate Isotope Effect In Chemical And Biological Reactions
9. Carcinogenic Metabolic Activation And Carcinogenic Mechanisms Of Naphthalene By The Cytochrome P450 Enzyme
10. Theoretical Study On The Mechanism Of Enzyme Degradation Of Biodegradable Polyester Plastics In Environment
11. Theoretical Insights Into Catalytic Mechanisms Of Several Heme And Non-Heme Enzymes
12. Theorectial Study On The Catalytic Mechanism Of Fluoroacetate Dehalogenase
13. Study On The Metabolic Activation And Degradation Mechanism Of Typical Endocrine Disrupting Chemicals Under The Action Of Enzymes
14. Evaluation Of XO Method Based On CASF2016?MCL-1 And CDK2 Test Set
15. Theoretical Studies On The Mechanisms Of Several Metalloenzymes And Radical Enzymes
16. Study On Degradation And Metabolism Activation Mechanism Of Typical Organochlorinated Pollutants Under The Action Of Biological Enzymes
17. Molecular Simulation Studies On Gas Adsorption, Diffusion And Catalytic Conversion Process On Micro-Mesoporous Materials
18. Application Of Combined QM/MM Method In Elucidating Solvent Effects Of Decarboxylation Reaction And Mechanism Of Disulfide Bond Exchange Reaction In Aqueous And Protein Environment
19. Theoretical Study On Degradation Mechanism Of Polyester Plastics Catalyzed By Hydrolase
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