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  1. MLChemistry MLChemistry Public

    prediction of different molecular property (HOMO-LUMO interaction gap,Dipole Moment ,polarisibility,Solubility)by allpying different ML algorithmn

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    PHREEQC geochemical modeling of Enhanced Rock Weathering in Darjeeling tea plantations for carbon removal quantification and agricultural soil enhancement

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    Study of Cis-Trans Photoisomerization in Stilbene and Ground state optimization of stilbene using different Theory.

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  4. enhanced-rock-weathering enhanced-rock-weathering Public

    Enhanced Rock Weathering Analysis using USGS Alaska Geochemical Database

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  5. Molecular-Geometry-Analysis Molecular-Geometry-Analysis Public

    Molecular-Geometry-Analysis.py

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  6. RDKit-descriptors-for-HOMO-LUMO-energy-gap-prediction RDKit-descriptors-for-HOMO-LUMO-energy-gap-prediction Public

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