The capabilities of MLatom 3 are described in the paper published in the J. Chem. Theory …
MLatom 3 for AI-enhanced computational chemistry: JCTC paper and online tutorial Read more →
MLatom@XACS team introduced how to use machine learning in chemistry in the CECAM Machine Learning and Quantum …
Tutorial on ML in CECAM school MLQCDyn featuring MLatom@XACS Read more →
My book chapter shows in a tutorial way how to use machine learning to assist quantum …
Chapter on Machine Learning in Quantum Chemistry in a Tutorial Way Read more →