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Pinned

  1. mlcolvar mlcolvar Public

    A unified framework for machine learning collective variables for enhanced sampling simulations

    Python 80 18

  2. plumed2 plumed2 Public

    Forked from plumed/plumed2

    Development version of plumed 2

    C++ 1

  3. data-driven-CVs data-driven-CVs Public

    Supporting material for the paper "Data driven collective variables for enhanced sampling"

    Brainfuck 15 4

  4. deep-learning-slow-modes deep-learning-slow-modes Public

    Supporting data for the manuscript "Deep learning the slow modes for rare events sampling"

    Roff 18 10

  5. masterclass-plumed masterclass-plumed Public

    Jupyter Notebook 10 6

  6. fessa-color-palette fessa-color-palette Public

    Python 5 2