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Computational Enzymology, a ReaxFF approach
Alessandro Corozzi
Department of Chemistry
Research output
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Book/Report
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Ph.D. thesis
›
Research
1287
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Engineering & Materials Science
Molecular mechanics
100%
Quantum theory
91%
Enzymes
72%
Catalysis
41%
Quantum chemistry
24%
Chemical reactivity
24%
Electronic structure
23%
Molecular structure
20%
Amino acids
18%
Potential energy
17%
Chemical reactions
15%
Mechanics
13%