Department of Biochemistry and Molecular Biophysics

Enspara: Modeling molecular ensembles with scalable data structures and parallel computing.

(Jan 28th, 2019)

Porter J.R., Zimmerman M.I., & Bowman G.R. (2019). “Enspara: Modeling molecular ensembles with scalable data structures and parallel computing.” J Chem Phys. 2019 Jan 28;150(4):044108. doi: 10.1063/1.5063794. (Abstract)