Simulating Protein Mediated Hydrolysis of ATP and Other Nucleoside Triphosphates by Combining QM/MM Molecular Dynamics with Advances in Metadynamics

• 期刊名称Journal of Chemical Theory and Computation
• 作者Sun, Rui; Sode, Olaseni; Dama, James F.; Voth, Gregory A.
• 印刷ISSN1549-9618
• 电子ISSN1549-9626
• 文件大小4684.21KB
• 发表时间2017-04-04
• DOI10.1021/acs.jctc.7b00077