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Issues: ExcitedStates/qfit-3.0
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generate individual polder maps around residues or segments
#439
opened Jun 24, 2024 by
stephaniewankowicz
Future enhancement for qFit ligand
enhancement
New feature or request
#397
opened Jan 31, 2024 by
jessicaflowers
Test & improve metrics for removing low density conformations
#346
opened Jun 8, 2023 by
stephaniewankowicz
qFit does not sample backbone if segment is less than 7 residues long
#331
opened Apr 26, 2023 by
stephaniewankowicz
Toggle RMSD cutoff values based on resolution
enhancement
New feature or request
#299
opened Dec 22, 2022 by
stephaniewankowicz
Duplicate conformations not collapsed in qfit_protein output-2NLV Tyr18, ChainA
#290
opened Nov 13, 2022 by
ss199514
CCTBX Conversion: Re-write all structure objects
CCTBX
enhancement
New feature or request
#235
opened Jul 17, 2022 by
stephaniewankowicz
CCTBX Conversion: Small changes in qfit.py
CCTBX
enhancement
New feature or request
#234
opened Jul 17, 2022 by
stephaniewankowicz
CCTBX Conversion: Transformation/F-calc function
CCTBX
enhancement
New feature or request
#233
opened Jul 17, 2022 by
stephaniewankowicz
CCTBX Conversion: Writing Maps
CCTBX
enhancement
New feature or request
priority:3-high
#207
opened May 4, 2022 by
stephaniewankowicz
CCTBX Conversion: Read in mmCIF files
CCTBX
enhancement
New feature or request
priority:3-high
#206
opened May 4, 2022 by
stephaniewankowicz
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