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libcifpp
Commit bec51594 by Maarten L. Hekkelman
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residue numbering in pdb, again...

parent f8da8360
Showing with 2 additions and 2 deletions
src/pdb/cif2pdb.cpp
...@@ -3459,8 +3459,8 @@ std::tuple<int, int> WriteCoordinatesForModel(std::ostream &pdbFile, const datab ...@@ -3459,8 +3459,8 @@ std::tuple<int, int> WriteCoordinatesForModel(std::ostream &pdbFile, const datab
resSeq = pdbx_branch_scheme.find1<int>("asym_id"_key == r.get<std::string>("label_asym_id") and "pdb_seq_num"_key == resSeq, "auth_seq_num"); resSeq = pdbx_branch_scheme.find1<int>("asym_id"_key == r.get<std::string>("label_asym_id") and "pdb_seq_num"_key == resSeq, "auth_seq_num");
// else if (type == "non-polymer") // same for non-polymers // else if (type == "non-polymer") // same for non-polymers
// resSeq = pdbx_nonpoly_scheme.find1<int>("asym_id"_key == r.get<std::string>("label_asym_id") and "pdb_seq_num"_key == resSeq, "auth_seq_num"); // resSeq = pdbx_nonpoly_scheme.find1<int>("asym_id"_key == r.get<std::string>("label_asym_id") and "pdb_seq_num"_key == resSeq, "auth_seq_num");
else if (type == "polymer") // else if (type == "polymer")
resSeq = pdbx_poly_seq_scheme.find1<int>("asym_id"_key == r.get<std::string>("label_asym_id") and "pdb_seq_num"_key == resSeq, "auth_seq_num"); // resSeq = pdbx_poly_seq_scheme.find1<int>("asym_id"_key == r.get<std::string>("label_asym_id") and "pdb_seq_num"_key == resSeq, "auth_seq_num");
} }
catch (const std::exception &ex) catch (const std::exception &ex)
{ {
......
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