Role of Water in the Puzzling Mechanism of the Final Aromatization Step Promoted by the Human Aromatase Enzyme. Insights from QM/MM MD Simulations
Title | Role of Water in the Puzzling Mechanism of the Final Aromatization Step Promoted by the Human Aromatase Enzyme. Insights from QM/MM MD Simulations |
Publication Type | Journal Article |
Year of Publication | 2015 |
Authors | Sgrignani, J, Iannuzzi, M, Magistrato, A |
Journal | Journal of Chemical Information and Modeling |
Volume | 55 |
Pagination | 2218-2226 |
URL | http://www.scopus.com/inward/record.url?eid=2-s2.0-84945558678&partnerID=40&md5=7ef470aa9bb694c745df20840c6baec4 |
DOI | 10.1021/acs.jcim.5b00249 |