Kelvin Lee's Projects
Testing github actions workflows on files
Automated, machine-learning driven scientific paper summarizer written in Python
Language models for astrochemistry
Cheminformatics tools for astrochemistry
Talk for Astrochemistry Discussions 2021 on unknown unknown's
A python script that will parse Astrochymist
Monthly newsletter building pipeline
Functions and classes to access online data resources. Maintainers: @keflavich and @bsipocz
This is my molecular python script for blender. A bit similar to Lagoa Multiphysic in Softimage.
Astropy affiliated package for reducing optical/IR CCD data
A set of Python routines for the electronic structure suite CFOUR
A set of notebooks for learning how to do chemistry in a Jupyter notebook
Code Base Investigator is a python tool to help examine the platform divergence of a code base.
A logical, reasonably standardized, but flexible project structure for doing and sharing data science work.
Cookiecutter template for a modern Python package.
Hypermodern PyTorch Project Cookiecutter
Scalable Machine Learning with Dask
Deep learning applied to ion image analysis
Routines that I'll be using for spectroscopy and dynamics.
EquiTriton is a project that seeks to implement high-performance kernels for commonly used building blocks in equivariant neural networks, enabling compute efficient training and inference.
Designing new redoxmers with ExaMol
Explainer for black box models that predict molecule properties
When certain routines are better written in Cython for faster processing.
A FTMW spectrum viewer written in Python and PyQt5
Simple cookiecutter template for automating a batch of Gaussian '16 calculations
Template for Green Bank Telescope observing proposal
My diary lol
Reference implementations of MLPerf™ HPC training benchmarks
dotfiles for work
Some routines for IPython notebook