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Projects in Awesome Lists by JacksonBurns

A curated list of projects in awesome lists by JacksonBurns .

https://github.com/jacksonburns/astartes

Better Data Splits for Machine Learning

ai data-science machine-learning ml python sampling

Last synced: 31 Oct 2024

https://github.com/jacksonburns/py2opsin

Simple Python interface to OPSIN: Open Parser for Systematic IUPAC nomenclature

Last synced: 31 Oct 2024

https://github.com/jacksonburns/py2sambvca

Simple thin client to interface python scripts with SambVca catalytic pocket fortran calculator.

chemistry fortran python-script

Last synced: 01 Nov 2024

https://github.com/jacksonburns/fastprop

Fast Molecular Property Prediction with mordredcommunity

chemistry machine-learning qspr

Last synced: 01 Nov 2024

https://jacksonburns.github.io/MATLAB-Start-to-Finish/

Lectures, code examples, and practice questions for teaching MATLAB for applications in undergraduate chemical engineering classes.

matlab practice-questions teaching-matlab

Last synced: 15 Oct 2024

https://github.com/jacksonburns/matlab-start-to-finish

Lectures, code examples, and practice questions for teaching MATLAB for applications in undergraduate chemical engineering classes.

matlab practice-questions teaching-matlab

Last synced: 24 Oct 2024

https://github.com/jacksonburns/presentable

Providing a Prettier Confusion Matrix for your Command Line

Last synced: 27 Oct 2024

https://github.com/jacksonburns/rmgdb

The ReactionMechanismGenerator Database Standard and Database

Last synced: 27 Oct 2024

https://github.com/jacksonburns/numlinelib

Plot number lines in Python

Last synced: 07 Oct 2024

https://github.com/jacksonburns/use-rse-23-astartes

Extrapolation and Interpolation in Machine Learning Modeling with Fast Food and astartes

extrapolation interpolation machine-learning reproducibility sampling

Last synced: 07 Oct 2024

https://github.com/jacksonburns/blank-python-project

Blank Python Project with Tests, Docs, Examples, GitHub Actions, and Packaging

Last synced: 08 Oct 2024

https://github.com/jacksonburns/py2sterimol

Thin client Python interface to the original Fortran implementation of Sterimol parameters

Last synced: 07 Oct 2024

https://github.com/jacksonburns/fastprop_llompart

fastprop on AqSolDBc and OChemCurated

Last synced: 07 Oct 2024

https://github.com/jacksonburns/xtb-ts-screener

Screening 'likely-to-converge' Transition States partially optimized by XTB

Last synced: 07 Oct 2024

https://github.com/jacksonburns/ralf

Rotation Angle Limit Finder

Last synced: 27 Oct 2024

https://github.com/jacksonburns/18337-project-template

Starter layout and paper format for 18.337 semester project

Last synced: 08 Oct 2024

https://github.com/jacksonburns/arclots

Predicting the selectivity of aryl-chloride/tosylate with ML

Last synced: 08 Oct 2024

https://github.com/jacksonburns/matlab_barlabel

MATLAB function to write the values of bars overtop in figures.

matlab

Last synced: 30 Oct 2024

https://github.com/jacksonburns/mtepor

Last synced: 07 Oct 2024

https://github.com/jacksonburns/hamdb

Heavy Metals and Monomers Database

Last synced: 07 Oct 2024