Trends in predicted chemoselectivity of cytochrome P450 oxidation: B3LYP barrier heights for epoxidation and hydroxylation reactions

Patrik Rydberg, Richard Lonsdale, Jeremy N. Harvey, Adrian J. Mulholland, Lars Olsen^*

^*Corresponding author for this work

Research output: Contribution to journal › Article (Academic Journal) › peer-review

18 Citations (Scopus)

2 Finished

2 results

Filter

Finished
CCP-BioSim: Biomolecular simulation at the life sciences interface
Mulholland, A. J.
1/10/11 → 1/10/15
Project: Research
COMPUTATIONAL BIOCHEMISTRY: PREDICTIVE MODELLING FOR BIOLOGY AND MEDICINE
Mulholland, A. J.
1/10/08 → 1/04/14
Project: Research