oxidation-state

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jedick / canprot

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Chemical analysis of proteins

r proteins amino-acid-composition chemical-metrics oxidation-state hydration-state isoelectric-point

Updated Sep 28, 2025
R

fb15649 / alphalaw

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Bond Order Scaling Law: 100% accurate molecular vs crystalline prediction for binary compounds. Cascade classifier L4→L5→L6 covering 76K JARVIS-DFT materials. No DFT required.

chemistry crystal-structure materials-science periodic-table cascade-classifier interpretable-ml dimensionality molecular-prediction scaling-law oxidation-state binary-compounds jarvis-dft bond-order staircase-method

Updated Apr 13, 2026
Python

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oxidation-state

Here are 2 public repositories matching this topic...

jedick / canprot

fb15649 / alphalaw

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