Skip to content
View mrauha's full-sized avatar

Highlights

  • Pro
Block or Report

Block or report mrauha

Block user

Prevent this user from interacting with your repositories and sending you notifications. Learn more about blocking users.

You must be logged in to block users.

Please don't include any personal information such as legal names or email addresses. Maximum 100 characters, markdown supported. This note will be visible to only you.
Report abuse

Contact GitHub support about this user’s behavior. Learn more about reporting abuse.

Report abuse

Popular repositories

  1. compchem_start compchem_start Public

    How to get started with computational chemistry research. Directed to new people in our lab, may be useful in general.

    12 3

  2. PyEnergyDiagrams PyEnergyDiagrams Public

    Forked from giacomomarchioro/PyEnergyDiagrams

    This is a simple script to plot energy profile diagrams using Python and matplotlib.

    Python 5

  3. scripts4compchem scripts4compchem Public

    Python 2

  4. simulation_of_biosystem_exercise simulation_of_biosystem_exercise Public

    Exercise for the modeling of biological systems course.

    Jupyter Notebook 2

  5. molmod molmod Public

    Forked from molmod/molmod

    MolMod is a collection of molecular modelling tools for python.

    Python 1

  6. qmflows qmflows Public

    Forked from SCM-NV/qmflows

    This library tackles the construction and efficient execution of computational chemistry workflows

    Jupyter Notebook 1