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@JLUsquad

JLUsquad

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  1. PresentJob PresentJob Public

    Python 1

  2. Disturbence Disturbence Public

    Fortran

  3. disturbance disturbance Public

    Python

  4. storage storage Public

  5. dscribe dscribe Public

    Forked from SINGROUP/dscribe

    DScribe is a python package for creating machine learning descriptors for atomistic systems.

    Python

  6. SOAPLite SOAPLite Public

    Forked from SINGROUP/SOAPLite

    Fast lightweight SOAP implementation for machine learning in quantum chemistry and materials physics.

    C

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Showing 9 of 9 repositories
  • disturbance Public
    JLUsquad/disturbance’s past year of commit activity
    Python 0 0 0 0 Updated Jan 18, 2019
  • PresentJob Public
    JLUsquad/PresentJob’s past year of commit activity
    Python 1 0 0 0 Updated Jan 6, 2019
  • rmsd Public Forked from charnley/rmsd

    Calculate Root-mean-square deviation (RMSD) of two molecules, using rotation, in xyz or pdb format

    JLUsquad/rmsd’s past year of commit activity
    Python 0 BSD-2-Clause 116 0 0 Updated Dec 3, 2018
  • QUIP Public Forked from libAtoms/QUIP

    libAtoms/QUIP molecular dynamics framework: http://www.libatoms.org

    JLUsquad/QUIP’s past year of commit activity
    Fortran 0 124 0 0 Updated Dec 1, 2018
  • storage Public
    JLUsquad/storage’s past year of commit activity
    0 0 0 0 Updated Nov 29, 2018
  • dscribe Public Forked from SINGROUP/dscribe

    DScribe is a python package for creating machine learning descriptors for atomistic systems.

    JLUsquad/dscribe’s past year of commit activity
    Python 0 Apache-2.0 91 0 0 Updated Nov 28, 2018
  • Disturbence Public
    JLUsquad/Disturbence’s past year of commit activity
    Fortran 0 0 0 0 Updated Nov 14, 2018
  • SOAPLite Public Forked from SINGROUP/SOAPLite

    Fast lightweight SOAP implementation for machine learning in quantum chemistry and materials physics.

    JLUsquad/SOAPLite’s past year of commit activity
    C 0 LGPL-3.0 9 0 0 Updated Nov 14, 2018
  • glosim Public Forked from lab-cosmo/glosim

    A Python package to compute similarities between molecules and structures

    JLUsquad/glosim’s past year of commit activity
    Python 0 MIT 12 0 0 Updated Apr 25, 2018

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