A package for Covalent Organic Frameworks structure assembly based on specific building block, topology and functional groups based on the reticular approach
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Updated
Sep 3, 2024 - Python
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reticular-chemistry
Here are 3 public repositories matching this topic...
An ecosystem for digital reticular chemistry
data-science
benchmark
machine-learning
metrics
ml
splitting
artificial-intelligence
hacktoberfest
descriptors
mof
featurization
metal-organic-frameworks
porous-materials
reticular-chemistry
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Updated
Sep 10, 2024 - Python
Python package for parallel calculation of energy voxels.
deep-learning
feature-engineering
voxels
material-science
metal-organic-frameworks
porous-materials
reticular-chemistry
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Updated
May 28, 2024 - Python
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