OpenMM 8: Molecular Dynamics Simulation with Machine Learning Potentials

MLA

Eastman, Peter, et al. “OpenMM 8: Molecular Dynamics Simulation with Machine Learning Potentials.” The Journal of Physical Chemistry - Part B, vol. 128, no. 1, Jan. 2024, pp. 109–16. EBSCOhost, https://doi.org/10.1021/acs.jpcb.3c06662.

APA

Eastman, P., Galvelis, R., Peláez, R. P., Abreu, C. R. A., Farr, S. E., Gallicchio, E., Gorenko, A., Henry, M. M., Hu, F., Huang, J., Krämer, A., Michel, J., Mitchell, J. A., Pande, V. S., Rodrigues, J. P., Rodriguez-Guerra, J., Simmonett, A. C., Singh, S., Swails, J., … Markland, T. E. (2024). OpenMM 8: Molecular Dynamics Simulation with Machine Learning Potentials. The Journal of Physical Chemistry - Part B, 128(1), 109–116. https://doi.org/10.1021/acs.jpcb.3c06662

Chicago

Eastman, Peter, Raimondas Galvelis, Raúl P. Peláez, Charlles R. A. Abreu, Stephen E. Farr, Emilio Gallicchio, Anton Gorenko, et al. 2024. “OpenMM 8: Molecular Dynamics Simulation with Machine Learning Potentials.” The Journal of Physical Chemistry - Part B 128 (1): 109–16. doi:10.1021/acs.jpcb.3c06662.