Pinned Repositories
cmselemental
Basic models for the Computational Molecular Sciences (CMS)
cookiecutter-cms
Python-centric Cookiecutter for Molecular Computational Chemistry Packages
ews_backend
Code to handle backend execution of education tasks.
mmic-web
molssi_devops
molssi_devops_old_example
oop_bootcamp19
oop_lesson_material
Examples for MIT Workshop
python-package-best-practices
Hands-on workshop showing good software development practices to create a Python package.
QCArchiveExamples
Getting started docs, examples, tutorials, and use cases.
sjayellis's Repositories
sjayellis/oop_lesson_material
Examples for MIT Workshop
sjayellis/cmselemental
Basic models for the Computational Molecular Sciences (CMS)
sjayellis/cookiecutter-cms
Python-centric Cookiecutter for Molecular Computational Chemistry Packages
sjayellis/ews_backend
Code to handle backend execution of education tasks.
sjayellis/mmic-web
sjayellis/molssi_devops
sjayellis/molssi_devops_old_example
sjayellis/oop_bootcamp19
sjayellis/python-package-best-practices
Hands-on workshop showing good software development practices to create a Python package.
sjayellis/QCArchiveExamples
Getting started docs, examples, tutorials, and use cases.
sjayellis/QCEngine
Quantum chemistry program executor and IO standardizer (QCSchema).
sjayellis/QCFractal
A distributed compute and database platform for quantum chemistry.