Aliaga, Jose I.; Alonso Jordá, Pedro; Badía Contelles, José Manuel; Chacon, Pablo; Davidovic, Davo; Lopez-Blanco, Jose R.; Quintana-Orti, Enrique S(Elsevier, 2016-03-15)
We introduce a new iterative Krylov subspace-based eigensolver for the simulation of
macromolecular motions on desktop multithreaded platforms equipped with multicore
processors and, possibly, a graphics accelerator ...