Python Scripting with COSMO-RS
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* pyCRS: a python wrapper for thermodynamic calculation

  * General Information

  * Overview

  * API

* Python scripting for COSMO-RS with PLAMS

  * General Information

  * Generating COSMO result file

  * Executing the code from the command line

  * Specifying a problem type

  * Inputting Compounds

  * Specifying mole fractions, temperatures, and pressures

  * Running jobs

  * Reading the results of a job

  * Plotting results

* Examples for pyCRS/PLAMS

  * pyCRS : Basic usage for Database and CRSManager

  * pyCRS : Conformer usage for Database and CRSManager

  * pyCRS : Basic usage for PropPred and FastSigma

  * Examples using PLAMS

  * Advanced scripting examples with PLAMS/pyCRS
