Using quantum chemistry, molecular simulation and machine learning techniques to study the enzymatic mechanism for several enzymes
博士 === 國立清華大學 === 分子醫學研究所 === 103 === Chapter I: Site of metabolism prediction for FMO enzymes via machine learning and condensed Fukui function The flavin-containing monooxygenase (FMO) catalyzes xenobiotics with soft nucleophiles and also plays an important role in drug metabolism in Phase I enzym...
| Main Authors: | , |
|---|---|
| Other Authors: | |
| Format: | Others |
| Language: | en_US |
| Published: |
2015
|
| Online Access: | http://ndltd.ncl.edu.tw/handle/j556k8 |