Alireza Khorshidi

The potential for machine learning in hybrid QM/MM calculations.

Yin-Jia Zhang, Alireza Khorshidi, Georg Kastlunger, 2018, The Journal of chemical physics.

Amp: A modular approach to machine learning in atomistic simulations

Alireza Khorshidi, Andrew A. Peterson, A. Peterson, 2016, Comput. Phys. Commun..

Addressing uncertainty in atomistic machine learning.

Alireza Khorshidi, Andrew Peterson, Rune Christensen, 2017, Physical chemistry chemical physics : PCCP.

Amp: Machine Learning for Atomistics v0.3alpha

Alireza Khorshidi, Andrew A. Peterson, 2015 .