MLatom – Dral's Group

Tag: MLatom

Paper on MLatom

Posted on June 20, 2019 by

Pavlo Dral Posted in Machine Learning in Chemistry, News — No Comments ↓

The mathematical and implementation details of the techniques available in MLatom: A Package for Atomistic Simulations with Machine Learning are reported.

Tagged with: JCC, ML, MLatom

MLatom 1.0

Posted on April 19, 2019 by

Pavlo Dral Posted in Machine Learning in Chemistry, Method Development, News — No Comments ↓

MLatom 1.0 release of my package for atomistic simulations with machine learning is now available.

Tagged with: ML, MLatom

News & Posts

Topics

Subscribe via Email