Ab initio QM/MM molecular dynamics using TeraChem and AMBER: Exploring environmental effects on the absorption spectrum of photoactive yellow protein
Title | Ab initio QM/MM molecular dynamics using TeraChem and AMBER: Exploring environmental effects on the absorption spectrum of photoactive yellow protein |
Publication Type | Conference Paper |
Year of Publication | 2012 |
Authors | Isborn CM, Goetz AW, Clark M, Martínez TJ, Walker RC |
Conference Name | ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY |
Publisher | AMER CHEMICAL SOC 1155 16TH ST, NW, WASHINGTON, DC 20036 USA |