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The script gets stuck at the compute_lrmsd_pdb2sql step

Status: Open.

#89In DeepRank/pdb2sql;

· hanjialu0810 opened on May 24, 2025

superpose() does not work when chain IDs are different and the residue numbering are different

Status: Open.

#88In DeepRank/pdb2sql;

· LilySnow opened on Sep 13, 2024

pdb2sql.transform.rot_mat does not allow to set center

Status: Open.

#87In DeepRank/pdb2sql;

· LilySnow opened on Mar 20, 2023

Refactor StructureSimilarity

stale

Status: Open.

#86In DeepRank/pdb2sql;

· NicoRenaud opened on Oct 3, 2022

compute_lrmsd_pdb2sql works only if there is no missing backbone atom

stale

Status: Open.

#85In DeepRank/pdb2sql;

· FarzanehParizi opened on Sep 30, 2022

add pdb matching function

stale

Status: Open.

#84In DeepRank/pdb2sql;

· LilySnow opened on Sep 27, 2022

pdb2sql selects one alternative location for atoms

stale

Status: Open.

#83In DeepRank/pdb2sql;

· FarzanehParizi opened on Sep 23, 2022

compute_irmsd_fast() only works on two chains

Status: Open.

#76In DeepRank/pdb2sql;

· LilySnow opened on Jul 11, 2022