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GNNPCSAFT CAPE-OPEN

GNNPCSAFT CAPE-OPEN is a Property Package CAPE-OPEN implementation of our project that focuses on using Graph Neural Networks (GNN) to estimate the pure-component parameters of the Equation of State PC-SAFT. We developed this app so the scientific community can access the model's results easily.

FeOs is used for PC-SAFT thermodynamic calculations such as VLE. Comtypes is used to implement the CAPE-OPEN COM interfaces. Only Windows is supported for now.

Other implementations with GNNPCSAFT:

How to Use

Installation

You need Python installed.

Installing the GNNPCSAFT CAPE-OPEN Property Package Server

pip install GNNPCSAFTPropertyPackage

Registering the Server

GNNPCSAFTPropertyPackage.exe -regserver

After registering the server, you can use it in any CAPE-OPEN compliant software.

Unregistering the Server

GNNPCSAFTPropertyPackage.exe -unregserver

License

GNU General Public License v3.0

Metadata

Release files for GNNPCSAFTPropertyPackage 0.2.0

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Source distribution for GNNPCSAFTPropertyPackage 0.2.0
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Table of built distributions (wheels) for GNNPCSAFTPropertyPackage 0.2.0
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gnnpcsaftpropertypackage-0.2.0-py3-none-any.whl Python 3 none any Details

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Release files / gnnpcsaftpropertypackage-0.2.0.tar.gz

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0.2.1

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0.2.0 This release

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0.1.0

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