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Achievement: Pull Sharkx2

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Achievement: Pull Sharkx2

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  1. GEMDAT-repos/GEMDATGEMDAT-repos/GEMDATPublic

    Python toolkit for molecular dynamics analysis

    Python 44 9

  2. Odegova-Valerie/DESignSolventsOdegova-Valerie/DESignSolventsPublic

    Jupyter Notebook 1

  3. GEMDAT-repos/gemdat-workshop-2025GEMDAT-repos/gemdat-workshop-2025Public

    Jupyter Notebook 2

  4. ai-chem/DESignSolventsai-chem/DESignSolventsPublic

    Jupyter Notebook 6

  5. Eutectic-predictionEutectic-predictionPublic

    ML model based on support vector regression integrating experimental data, COSMO-RS simulations, and cheminformatic descriptors for computing the melting points of deep eutectic solvents and predic…

    Jupyter Notebook 10 1