schlaicha

Alexander Schlaich's starred repositories

yapf

A formatter for Python files

Language:PythonApache-2.01370200

atomify

Atomify - a realtime LAMMPS visualizer

Language:C++GPL-3.014800

InterMol

Conversion tool for molecular simulations

Language:PythonMIT18200

ipython

Official repository for IPython itself. Other repos in the IPython organization contain things like the website, documentation builds, etc.

Language:PythonBSD-3-Clause1620000

cite2c

Citations in the Jupyter Notebook

Language:JavaScriptMIT31700

pymbar

Python implementation of the multistate Bennett acceptance ratio (MBAR)

Language:PythonMIT22800

alchemical-analysis

An open tool implementing some recommended practices for analyzing alchemical free energy calculations

Language:PythonMIT11000

mdanalysis

MDAnalysis is a Python library to analyze molecular dynamics simulations.

Language:PythonNOASSERTION126300

jupyter_contrib_nbextensions

A collection of various notebook extensions for Jupyter

Language:JavaScriptNOASSERTION520100

zandy

Zotero on Android

Language:JavaAGPL-3.014400

nmrlipids.blogspot.fi

Files related to the nmrlipids.blogspot.fi

Language:TeXGPL-2.0700

gromacs

OpenCL porting of the GROMACS molecular simulation toolkit

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dune-pnp

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dune-pnp

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espresso

The ESPResSo package

Language:C++GPL-3.0100

espresso

The ESPResSo package

Language:C++GPL-3.022200

ipbs

IPBS - An iterative Poisson-Boltzmann solver for regions with dielectric mismatch

Language:C++200