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Issues list

Side chain clashes in docks. bug Something isn't working. high priority Above average priority.
#415 opened Dec 23, 2023 by primaryodors
2
The drift is pulling ligands away from established binding sites. bug Something isn't working. high priority Above average priority. retest Check if this is still happening.
#137 opened Oct 5, 2022 by electronicsbyjulie
@electronicsbyjulie
4
Scripting: CONNECT does not reliably connect broken strands. bug Something isn't working. help wanted Extra attention is requested.
#74 opened Jun 26, 2022 by electronicsbyjulie
4
Structural anomaly calculation is wrong. bug Something isn't working. help wanted Extra attention is requested. retest Check if this is still happening.
#65 opened Jun 11, 2022 by electronicsbyjulie
@electronicsbyjulie
2
Multiple SMILES issues, including aromatic rings not being made coplanar. bug Something isn't working. help wanted Extra attention is requested. low priority Not a show stopper, but should be addressed.
#5 opened May 24, 2022 by electronicsbyjulie
15
SMILES parse issue: numbers only work with already-bonded atoms. bug Something isn't working. low priority Not a show stopper, but should be addressed.
#4 opened May 24, 2022 by electronicsbyjulie
The classes likely still leak some memory. bug Something isn't working. help wanted Extra attention is requested.
#3 opened May 24, 2022 by electronicsbyjulie
2
Molecule::get_ring_normal() only works with coplanar rings. bug Something isn't working. good first issue Good for newcomers. help wanted Extra attention is requested.
#1 opened May 24, 2022 by electronicsbyjulie
ProTip! no:milestone will show everything without a milestone.