matbench-discovery
Materials prediction framework
An evaluation framework for machine learning models simulating high-throughput materials discovery.
An evaluation framework for machine learning models simulating high-throughput materials discovery.
107 stars
8 watching
17 forks
Language: Python
last commit: 5 days ago
Linked from 1 awesome list
bayesian-optimizationconvex-hullhigh-throughput-searchinteratomic-potentialmachine-learningmaterials-discovery
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