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| # <img align="top" src="https://raw.githubusercontent.com/ReactionMechanismGenerator/RMG-Py/master/documentation/source/_static/rmg-logo-small.png"> RMG Py - Reaction Mechanism Generator (Python Version) | ||
| # <img align="top" src="https://raw.githubusercontent.com/ReactionMechanismGenerator/RMG-Py/master/documentation/source/_static/rmg-logo-small.png"> Reaction Mechanism Generator (RMG) | ||
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| This repository contains the Python version of Reaction Mechanism Generator | ||
| (RMG), a tool for automatically generating chemical reaction | ||
| ## Description | ||
| This repository contains the Python version of **Reaction Mechanism Generator (RMG)**, | ||
| a tool for automatically generating chemical reaction | ||
| mechanisms for modeling reaction systems including pyrolysis, combustion, | ||
| atmospheric science, and more. | ||
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| It also includes CanTherm, the package for calculating thermodynamics, high-pressure-limit | ||
| It also includes **CanTherm**, the package for calculating thermodynamics, high-pressure-limit | ||
| rate coefficients, and pressure dependent rate coefficients from quantum chemical calculations. | ||
| CanTherm is compatible with a variety of ab initio quantum chemistry software programs, including but not limited to | ||
| Gaussian, MOPAC, QChem, and MOLPRO. | ||
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| The most official repository can be found on github and is located at https://github.com/ReactionMechanismGenerator/RMG-Py. | ||
| Instructions on how to use RMG can be found in the [RMG Documentation](http://ReactionMechanismGenerator.github.io/RMG-Py/) including | ||
| details on [how to install RMG-Py](http://ReactionMechanismGenerator.github.io/RMG-Py/users/rmg/installation/index.html) | ||
| and its numerous dependencies. The [CanTherm Documentation](http://ReactionMechanismGenerator.github.io/RMG-Py/users/cantherm/) is also available online. | ||
| PDF versions of all the documentation can also be found in the documentation folder of the source code. | ||
| ## Source Code Repository | ||
| - [RMG Github Repository](https://github.com/ReactionMechanismGenerator/RMG-Py): contains the latest source code for RMG | ||
| - [RMG-database Github Repository](https://github.com/ReactionMechanismGenerator/RMG-database): contains source code for the latest version of the database | ||
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| ## Latest Stable Release | ||
| **RMG v1.0.2** | ||
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| View the [Release Notes](http://reactionmechanismgenerator.github.io/RMG-Py/users/rmg/releaseNotes.html). | ||
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| RMG is developed primarily by researchers in | ||
| [Prof. William Green's research group](http://cheme.scripts.mit.edu/green-group/) at the | ||
| ## How to Install | ||
| View the [Download and Install](http://reactionmechanismgenerator.github.io/RMG-Py/users/rmg/installation/index.html) page. | ||
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| ## Documentation | ||
| - [RMG Documentation](http://ReactionMechanismGenerator.github.io/RMG-Py/) ([PDF version](https://github.com/ReactionMechanismGenerator/RMG-Py/raw/master/documentation/RMG-Py_and_CanTherm_Documentation.pdf)) | ||
| - [CanTherm Documentation](http://ReactionMechanismGenerator.github.io/RMG-Py/users/cantherm/) ([PDF version](https://github.com/ReactionMechanismGenerator/RMG-Py/raw/master/documentation/RMG-Py_and_CanTherm_Documentation.pdf)) | ||
| - [RMG API Reference](http://reactionmechanismgenerator.github.io/RMG-Py/reference/index.html) ([PDF version](https://github.com/ReactionMechanismGenerator/RMG-Py/raw/master/documentation/RMG-Py_API_Reference.pdf)) | ||
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| Alternatively, PDF versions of all the documentation can also be found in the `documentation` folder of the source code. | ||
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| ## Credits | ||
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| - [Professor William H. Green's research group](http://cheme.scripts.mit.edu/green-group/) at the | ||
| [Massachusetts Institute of Technology](http://web.mit.edu/) | ||
| and [Prof. Richard West's research group](http://www.northeastern.edu/comocheng/) at | ||
| - [Professor Richard H. West's research group](http://www.northeastern.edu/comocheng/) at | ||
| [Northeastern University](http://www.northeastern.edu/). | ||
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| ## How to Give Feedback | ||
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| Please post any issues you may have to the [issues page](https://github.com/ReactionMechanismGenerator/RMG-Py/issues/) | ||
| or email [[email protected]](mailto:[email protected]) if you have questions. | ||
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| ## Useful Links | ||
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| - [Interactive Website](http://rmg.mit.edu): Visit this site to visualize RMG-generated models, view the databases, and | ||
| perform thermodynamics and kinetics searches | ||
| - [Wiki](https://github.com/ReactionMechanismGenerator/RMG-Py/wiki): a wiki for developer notes | ||
| - [Issues Page](https://github.com/ReactionMechanismGenerator/RMG-Py/issues/): view current issues and feature requests | ||
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| ## Continuous Integration | ||
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| We have a continuous integration build test suite | ||
| which you can access at https://travis-ci.org/ReactionMechanismGenerator/RMG-Py | ||
| The current build status is | ||
| [](https://travis-ci.org/ReactionMechanismGenerator/RMG-Py) | ||
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| Details of the (earlier established) Java version of RMG can be found | ||
| on [Sourceforge](http://rmg.sourceforge.net/) (although it too is | ||
| developed [here on github](https://github.com/ReactionMechanismGenerator/RMG-Java/)). | ||
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| Please post any issues you may have to the [issues page](https://github.com/ReactionMechanismGenerator/RMG-Py/issues/) | ||
| or email [[email protected]](mailto:[email protected]) if you have questions. | ||
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