jevandezande Goto Github PK
Name: Jonathon Vandezande
Type: User
Company: @rowansci
Bio: Director of Computational Chemistry @rowansci
Location: Boston, MA
Name: Jonathon Vandezande
Type: User
Company: @rowansci
Bio: Director of Computational Chemistry @rowansci
Location: Boston, MA
basis
Python-based library for working with computational chemistry files
Python client for TeraChem Cloud
Vector graphic molecule viewer
Generates clusters à la DOI: 10.1039/c3cp50709b
The Python programming language
Conformer-Rotamer Ensemble Sampling Tool based on the xtb Semiempirical Extended Tight-Binding Program Package
https://crest-lab.github.io/crest-docs/
LaTeX dissertation template based on UGA guidelines
Collection of all my dotfiles
Methods for reading, plotting, and manipulating elongation data. Currently supports the MT-2500.
A Swiss Army knife iterator for files (or any iterator of strings)
SGE submitter
Cookiecutter for setting up python projects with pipenv that just work
Cookiecutter for setting up python projects with pixi that just work
Cookiecutter for setting up python projects with Poetry
Pourbaix diagrams for a variety of elements
molecular point group symmetry lib
Repository for various quantum chemistry program helper scripts
Reaction Progress program, DOI: 10.1021/ed400069d
Reaction path plotter
Random code snippets that I find useful
A package for plotting and manipulating 1D spectra
Introduction to Statistical Mechanics - Peter Eastman
A scheduler for GPU/CPU tasks
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.