mlmd

There are 0 repository under mlmd topic.

Bin-Cao / Bgolearn
A Bayesian global optimization package for material design ｜ Adaptive Learning | Active Learning
expected-improvement knowledge-gradient material-design bayesian-global-optimization predictive-entropy-search probability-of-improvement upper-confidence-bound entropy-based-approach least-confidence margin-sampling augmented-expected-improvement opportunity-cost trail-path active-learning adaptive-learning materials materials-informatics materials-science mlmd bgolearn
Language:Jupyter Notebook 82
selvachandrasekaranselvaraj / AtomicAI
Machine learning force fields and classification of atoms in a complex MD trajectory
mlmd
Language:Python 0