Machine learning for parameter auto-tuning in molecular dynamics simulations: Efficient dynamics of ions near polarizable nanoparticles

J. C. S. Kadupitiya, Geoffrey C. Fox, Vikram Jadhao. Machine learning for parameter auto-tuning in molecular dynamics simulations: Efficient dynamics of ions near polarizable nanoparticles. IJHPCA, 34(3), 2020. [doi]

Abstract

Abstract is missing.