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implement graph-spectral features
enhancement
New feature or request
#71
opened May 9, 2022 by
kjappelbaum
implement New feature or request
fit
and fit_transform
on energygrid
enhancement
#40
opened Apr 25, 2022 by
kjappelbaum
refactor New feature or request
quality-of-life
get_neighbors_at_distance
enhancement
#42
opened Apr 25, 2022 by
kjappelbaum
implement site dataset
dataset
enhancement
New feature or request
#52
opened May 6, 2022 by
kjappelbaum
refactor RACs featurizer to site-based featurizer
blocking
enhancement
New feature or request
good first issue
Good for newcomers
how handle datasets that might not fit into memory
enhancement
New feature or request
#57
opened May 9, 2022 by
kjappelbaum
add maintainer documentation on how to update datasets
documentation
Improvements or additions to documentation
enhancement
New feature or request
how do we handle New feature or request
question
Further information is requested
fit_transform
for featurize_many
enhancement
#59
opened May 9, 2022 by
kjappelbaum
perhaps run all reference structures through New feature or request
manage_crystal
?
enhancement
#61
opened May 9, 2022 by
kjappelbaum
vectorize atom-centered PH using images and/or Gaussian mixtures
enhancement
New feature or request
featurizers/persistent-homology
help wanted
Extra attention is needed
#65
opened May 9, 2022 by
kjappelbaum
implement pore-centered PH featurizer
enhancement
New feature or request
featurizers/persistent-homology
#70
opened May 9, 2022 by
kjappelbaum
implement diversity metrics
enhancement
New feature or request
#77
opened May 9, 2022 by
kjappelbaum
avoid that New feature or request
help wanted
Extra attention is needed
quality-of-life
pyeqeq
pollutes the output
enhancement
#85
opened May 10, 2022 by
kjappelbaum
cache TDA calls
enhancement
New feature or request
featurizers/persistent-homology
help wanted
Extra attention is needed
#89
opened May 10, 2022 by
kjappelbaum
also implement New feature or request
featurizers/persistent-homology
fit_transform
for PHImage
enhancement
#91
opened May 10, 2022 by
kjappelbaum
for persistent homology featurizers implement option to sample more points
enhancement
New feature or request
#92
opened May 10, 2022 by
kjappelbaum
reduce duplicated code in TDA
enhancement
New feature or request
featurizers/persistent-homology
quality-of-life
#96
opened May 13, 2022 by
kjappelbaum
make New feature or request
fit_transform
available on all featurizers and MultipleFeaturizers
blocking
enhancement
#100
opened May 19, 2022 by
kjappelbaum
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Updated in the last three days: updated:>2025-03-01.