yqshao's Stars
nglviewer/nglview
Jupyter widget to interactively view molecular structures and trajectories
jkitchin/scimax
An emacs starterkit for scientists and engineers
floodsung/Deep-Learning-Papers-Reading-Roadmap
Deep Learning papers reading roadmap for anyone who are eager to learn this amazing tech!
prtkm/vasp
New ASE compliant Python interface to VASP
jkitchin/org-ref
org-mode modules for citations, cross-references, bibliographies in org-mode and useful bibtex tools to go with it.
chemlab/chemlab
The chemistry library you were waiting for
3dmol/3Dmol.js
WebGL accelerated JavaScript molecular graphics library
Autodesk/notebook-molecular-visualization
2D and 3D molecular visualization in Jupyter notebooks using 3DMol.js and D3.js
hakimel/reveal.js
The HTML Presentation Framework
ipython/ipython
Official repository for IPython itself. Other repos in the IPython organization contain things like the website, documentation builds, etc.
jkitchin/vasp
New ASE compliant Python interface to VASP
PytLab/VASPy
Manipulating VASP files with Python.