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icqms

Popular repositories

  1. strongHB strongHB Public

    DIGITAL Command Language 1

  2. 1JBO-2016 1JBO-2016 Public

    Fortran

  3. 2VB1-2016 2VB1-2016 Public

    Fortran

  4. qr-tests-p26 qr-tests-p26 Public

    Isolated small peptides containing an aromatic side chain for testing quantum refinement.

    Python

  5. qr-tests-3p4j qr-tests-3p4j Public

    Z-DNA at 0.55 A as a test for quantum refinement

  6. qr-tests-2y3j qr-tests-2y3j Public

    Structure of segment from the Amyloid-Beta peptide as a test for quantum refinement

Repositories

Showing 10 of 21 repositories
  • i-pi Public Forked from i-pi/i-pi-archive

    A Python wrapper for (ab initio) (path integrals) molecular dynamics

    icqms/i-pi’s past year of commit activity
    Python 0 24 0 0 Updated Feb 16, 2018
  • deepchem Public Forked from deepchem/deepchem

    Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

    icqms/deepchem’s past year of commit activity
    Python 0 MIT 1,664 0 0 Updated Feb 10, 2018
  • handson-ml Public Forked from ageron/handson-ml

    A series of Jupyter notebooks that walk you through the fundamentals of Machine Learning and Deep Learning in python using Scikit-Learn and TensorFlow.

    icqms/handson-ml’s past year of commit activity
    Jupyter Notebook 0 Apache-2.0 13,010 0 0 Updated Jan 18, 2018
  • qr-addwater Public
    icqms/qr-addwater’s past year of commit activity
    Python 0 1 0 0 Updated Sep 10, 2016
  • qr-tests-p26 Public

    Isolated small peptides containing an aromatic side chain for testing quantum refinement.

    icqms/qr-tests-p26’s past year of commit activity
    Python 0 0 0 0 Updated Jun 11, 2016
  • qr-tests-2ona Public
    icqms/qr-tests-2ona’s past year of commit activity
    0 0 1 0 Updated Jun 10, 2016
  • qr-tests-2y3j Public

    Structure of segment from the Amyloid-Beta peptide as a test for quantum refinement

    icqms/qr-tests-2y3j’s past year of commit activity
    0 0 0 0 Updated Mar 26, 2016
  • qr-tests-3p4j Public

    Z-DNA at 0.55 A as a test for quantum refinement

    icqms/qr-tests-3p4j’s past year of commit activity
    0 0 0 0 Updated Mar 26, 2016
  • qr-tests-2ol9 Public

    Residues 170-175 of human prion for testing quantum refinement

    icqms/qr-tests-2ol9’s past year of commit activity
    0 0 0 0 Updated Mar 26, 2016
  • strongHB Public
    icqms/strongHB’s past year of commit activity
    DIGITAL Command Language 1 0 1 0 Updated Mar 26, 2016
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