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Machine learning scripts and data used for O2/N2 separation study.

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Scripts for gathering MOF features. Initially used in machine learning paper for O2/N2 separation.

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Scripts Used For Cluster Automation, Including Forcefields and Scripts for Modifying CIFs (removing charges, translating along axes etc.)

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Effective Point Charge Descriptors

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For personal use, but anyone can access to find bits useful to them

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