jwallen/RPMDrate
Compute dynamic properties of chemical systems using ring polymer molecular dynamics simulations
A Python wrapper for the DASSL, DASPK, and DASKR differential algebraic system solvers
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Compute dynamic properties of chemical systems using ring polymer molecular dynamics simulations
A Python package for computing chemical reaction rates and other properties needed for detailed kinetics models
The database of chemical parameters used with Reaction Mechanism Generator
A Django-powered website for Reaction Mechanism Generator (RMG)