Matt Johnson's repositories
julia-feedstock
A conda-smithy repository for julia.
project-website
a template for research group sites
Q2DTor
Q2DTor is a program designed to calculate partition functions and thermodynamic properties of molecular systems with two or more torsional modes. It allows one to calculate rotational-vibrational (or rovibrational) partition functions and thermodynamic functions by the multistructural harmonic oscillator (MS-HO) and the Extended Two-Dimensional Torsion (E2DT) methods.
ReactionMechanismSimulator.jl
The amazing Reaction Mechanism Simulator for simulating large chemical kinetic mechanisms
RingDecomposerLib
Open Source Implementation of the Unique Ring Families Algorithm (Cheminformatics)
RMG-database
The database of chemical parameters used with Reaction Mechanism Generator
RMG-tests
Continous Integration Testing Platform for RMG-Py
staged-recipes
A place to submit conda recipes before they become fully fledged conda-forge feedstocks