![High-Performance Drug Discovery: Computational Screening by Combining Docking and Molecular Dynamics Simulations]()
High-Performance Drug Discovery: Computational Screening by Combining Docking and Molecular Dynamics SimulationsOkimoto, Noriaki; Futatsugi, Noriyuki; Fuji, Hideyoshi; Suenaga, Atsushi; Morimoto, Gentaro; Yanai, Ryoko; Ohno, Yousuke; Narumi, Tetsu; Taiji, Makoto; Case, David · PLoS Computational Biology · 2009