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Popular repositories

  1. Drug-Structure-Property-Relationships Drug-Structure-Property-Relationships Public

    Featurization and regression for predicting drug physicochemical properties

    Jupyter Notebook 1

  2. Monte-Carlo-Parallel-Tempering Monte-Carlo-Parallel-Tempering Public

    Simulated annealing technique to enhance Monte Carlo sampling efficiency

    Jupyter Notebook 1

  3. pscf pscf Public

    Forked from dmorse/pscf

    Polymer self-consistent field theory

    Fortran

  4. pscf-examples pscf-examples Public

    Forked from dmorse/pscf-examples

    Examples for pscf (polymer self-consistent field theory)

    Python

  5. Chemometrics Chemometrics Public

    Dimensionality reduction tools for multivariate analysis

    Jupyter Notebook 1