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yhayashi1986/PolyOmics

PolyOmics PolyOmics is an omics-scale computational materials database containing molecular structures, simulation metadata, and diverse physical properties for more than (10^5) polymeric materials. The database was generated primarily using RadonPy, a fully automated molecular dynamics (MD) simulation platform for polymer materials. PolyOmics was developed through a large-scale collaboration of the RadonPy Consortium to provide foundational computational data for polymer… See the full description on the dataset page: https://huggingface.co/datasets/yhayashi1986/PolyOmics.

Author / organizationyhayashi1986
License (as declared)cc-by-4.0
Downloads1.5K (as reported by Hugging Face)
Likes19
Created4 September 2025
Last updated at source3 September 2026
chemistrymaterials-sciencepolymerpolymersmolecular-dynamicscomputational-chemistrymaterials-informaticsmolecular-property-predictionradonpysimulationsim2real
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