Molecular size calculations for enzyme reaction screening in metal--organic frameworks
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Updated
Feb 10, 2021 - Jupyter Notebook
Molecular size calculations for enzyme reaction screening in metal--organic frameworks
Sequential design of adsorption simulation for small molecule adsorption in a MOF
A code to generate MOFs structure with a specific structure design
Wrapper around the mofDB api for easy python use
Python code to initialize adsorbates on MOFs
featurizing MOFs for the oximachine
A system for rapid identification and analysis of metal-organic frameworks
An Active learning algorithm for multi-component adsorption prediction in MOF
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