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@jensengroup @ppqm @steinmanngroup @gms-bbg @qmlcode @chemspacelab
charnley/README.md
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- I like VIM and TMUX
- I like Python and Fortran
- I like Quantum Chemistry and Cheminformatics

But mostly
- I like Makefiles and templates

Pinned

  1. My enviromental dotfiles

    Shell 2 2

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

    Python 174 58

  3. MolCalc is a web interface that allows anyone to build molecules and calculate molecular properties online

    HTML 47 10

  4. QML: Quantum Machine Learning

    Python 121 50

  5. See http://dx.doi.org/10.1039/C7SC04156J for more details

    Python 10 4

  6. Determination of statistical significance using composite errors

    Python 2 2

537 contributions in the last year

Sep Oct Nov Dec Jan Feb Mar Apr May Jun Jul Aug Mon Wed Fri
Activity overview
Contributed to chemspacelab/meltingpoint, charnley/dotfiles, jensengroup/molcalc and 5 other repositories
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Contribution activity

September 2020

charnley has no activity yet for this period.

August 2020

9 contributions in private repositories Aug 1 – Aug 30

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