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Open Graph Title: DeepRank/pdb2sql

X Title: DeepRank/pdb2sql

Description: Fast and versatile biomolecular structure PDB file parser using SQL queries - DeepRank/pdb2sql

Open Graph Description: Fast and versatile biomolecular structure PDB file parser using SQL queries - DeepRank/pdb2sql

X Description: Fast and versatile biomolecular structure PDB file parser using SQL queries - DeepRank/pdb2sql

Opengraph URL: https://github.com/DeepRank/pdb2sql

X: @github

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The script gets stuck at the compute_lrmsd_pdb2sql stephttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/89
hanjialu0810https://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20author%3Ahanjialu0810
superpose() does not work when chain IDs are different and the residue numbering are differenthttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/88
LilySnowhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20author%3ALilySnow
pdb2sql.transform.rot_mat does not allow to set centerhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/87
LilySnowhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20author%3ALilySnow
Refactor StructureSimilarityhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/86
stalehttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20label%3Astale
NicoRenaudhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20author%3ANicoRenaud
compute_lrmsd_pdb2sql works only if there is no missing backbone atomhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/85
stalehttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20label%3Astale
FarzanehParizihttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20author%3AFarzanehParizi
add pdb matching functionhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/84
stalehttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20label%3Astale
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pdb2sql selects one alternative location for atoms https://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/83
stalehttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20label%3Astale
FarzanehParizihttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20author%3AFarzanehParizi
compute_irmsd_fast() only works on two chainshttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues/76
LilySnowhttps://patch-diff.githubusercontent.com/DeepRank/pdb2sql/issues?q=is%3Aissue%20state%3Aopen%20author%3ALilySnow
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