RMG-Py v1.0.3

• Pdep convergence issues in RMG-Py v1.0.2 are now fixed.
• RMG-database version information and anaconda binary version information is now recorded in the RMG log file.

RMG-Py v1.0.2

• Windows users can rejoice: RMG is now available in binary format on the Anaconda platform. Building by source is also much easier now through the Anaconda managed python environment for dependencies. See the updated Installation Page for more details
• Reaction filtering for speeding up model generation has now been added. It has been shown to speed up model convergence by 7-10x. See more details about how to use it in your RMG job here. Learn more about the theory and algorithm on the Rate-based Model Enlarging Algorithm page.
• The RMG native scripts are now organized under the rmgpy.tools submodule for developer ease and better extensibility in external scripts.
• InChI conversion is now more robust for singlets and triplets, and augmented InChIs and InChI keys are now possible with new radical electron, lone pair, and multiplicity flags.
• Output HTML for visualizing models are now cleaned up and also more functional, including features to display thermo comments, display enthalpy, entropy, and free energy of reaction, as well as filter reactions by species. You can use this new visualization format either by running a job in RMG v1.0.2 or revisualizing your CHEMKIN file and species dictionary using the visualization web tool