MixtureMetrics: A comprehensive package to develop additive numerical features to describe complex materials for machine learning modeling
Multi-component materials/compounds and polymeric/composite systems pose structural complexity that challenges the conventional methods of molecular representation in cheminformatics, which have limited applicability in such cases. Therefore, we have introduced an innovative structural representatio...
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| Huvudupphov: | , , , |
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| Materialtyp: | Artigo |
| Språk: | Inglês |
| Utgiven: |
Elsevier
2024-12-01
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| Serie: | SoftwareX |
| Ämnen: | |
| Länkar: | http://www.sciencedirect.com/science/article/pii/S2352711024002814 |
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