Comparison of Linear-Scaling Semiempirical Methods and Combined Quantum Mechanical/Molecular Mechanical Methods for Enzymic Reactions. II. An Energy Decomposition Analysis.
Citation
Titmuss, S, Cummins, P, Rendell, A et al 2002, 'Comparison of Linear-Scaling Semiempirical Methods and Combined Quantum Mechanical/Molecular Mechanical Methods for Enzymic Reactions. II. An Energy Decomposition Analysis.', Journal of Computational Chemistry, vol. 23, pp. 1314-1322.
Year
2002
Fields of Research
- Theoretical And Computational Chemistry Not Elsewhere Classified
- Enzymes