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import error in <code>oddt.surface</code>

Status: Open.

#180 In oddt/oddt;

· oopstom opened on Sep 27, 2024

TypeError: iteration over a 0-d array

Status: Open.

#179 In oddt/oddt;

· jpgcorreia opened on Sep 5, 2024

manually defining atomic charges

Status: Open.

#178 In oddt/oddt;

· bobbypaton opened on May 24, 2024

Question about retrain your model on PDBbind-2016 by modifying the 'act' column

Status: Open.

#176 In oddt/oddt;

· RJ-Li opened on Nov 7, 2023

for mol in ligands: TypeError: 'NoneType' object is not iterable

Status: Open.

#175 In oddt/oddt;

· RJ-Li opened on Nov 7, 2023

rf = RFScore() TypeError: 'module' object is not callable

Status: Open.

#174 In oddt/oddt;

· SanFran-Me opened on Nov 6, 2023

toolkit not being recognised

Status: Open.

#173 In oddt/oddt;

· tdudgeon opened on Sep 19, 2023

AttributeError: module 'openbabel.openbabel' has no attribute 'OBElementTable'

Status: Open.

#172 In oddt/oddt;

· nickyoungforu opened on Sep 1, 2023

pip installation failed -

Status: Open.

#169 In oddt/oddt;

· dansteiert opened on Apr 13, 2023

oodt syntax error

Status: Open.

#168 In oddt/oddt;

· priyanshu687 opened on Feb 24, 2023

Training scoring functions and updated version of PDBBind

Status: Open.

#167 In oddt/oddt;

· Tonylac77 opened on Feb 9, 2023

RDKIT molecule

Status: Open.

#166 In oddt/oddt;

· silviamenin opened on Feb 8, 2023