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11 Open 2 Closed
11 Open 2 Closed
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Issues list

Different fingerprints results from PubChemFingerprints.py and PubChemPy module.
#24 opened May 20, 2024 by jslee-hits
PubChem fingerprint implementation contains bad algorithm for features #116 to #255; and bad implementation of feature #60
#23 opened Apr 19, 2023 by ZlatomirTodorov
1
constitution doesn't work on python3
#22 opened Jan 17, 2023 by sunglyoungKim
When I calculated the result of PubChem fingerprint, it was different from that of Padel software. Did anyone notice this problem, or did I make a mistake? Attached is my program
#21 opened Sep 9, 2022 by Ls94wood
1
What version of RDKit was used when building PyBioMed
#20 opened Sep 7, 2022 by Ls94wood
1
AttributeError: ‘url’ has no attribute ‘urlretrieve’ when calcutating AAindex
#18 opened May 17, 2022 by TeddyGlass
More bugs experience whenever I try to refactor the code
#12 opened Sep 28, 2020 by danielmuthama
Error while calculating Kappa Descriptor
#11 opened May 11, 2020 by omkarfirame
2
Error while calculating Basak information
#10 opened May 11, 2020 by omkarfirame
2
Python 3 support
#3 opened Feb 21, 2020 by MartinThoma
4
ZeroDivisionError when computing molecular descriptors
#1 opened Apr 24, 2019 by lorenzoFabbri
2
ProTip! Exclude everything labeled bug with -label:bug.