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FoldseekBase.cpp update (#306)
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* explanation complex -> multimer

* explanation complex -> multimer
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sooyoung-cha committed Jul 15, 2024
1 parent 25812ff commit bc212bc
Showing 1 changed file with 9 additions and 9 deletions.
18 changes: 9 additions & 9 deletions src/FoldseekBase.cpp
Original file line number Diff line number Diff line change
Expand Up @@ -258,8 +258,8 @@ std::vector<Command> foldseekCommands = {
CITATION_FOLDSEEK, {{"Db", DbType::ACCESS_MODE_INPUT, DbType::NEED_DATA|DbType::NEED_HEADER, &DbValidator::sequenceDb },
{"pdbFile", DbType::ACCESS_MODE_OUTPUT, DbType::NEED_DATA, &DbValidator::flatfile}}},
{"scoremultimer", scoremultimer, &localPar.scoremultimer, COMMAND_ALIGNMENT,
"Get complex level alignments from alignmentDB",
"# Get complex level alignments (chain assignments and tm-scores) from alignmentDB.\n"
"Get multimer level alignments from alignmentDB",
"# Get multimer level alignments (chain assignments and tm-scores) from alignmentDB.\n"
"foldseek scoremultimer queryDB targetDB alignmentDB complexDB\n"
"# simple tsv output format"
"foldseek createmultimerreport queryDB targetDB complexDB result.tsv"
Expand All @@ -278,8 +278,8 @@ std::vector<Command> foldseekCommands = {
"", NULL, "", "", CITATION_FOLDSEEK_MULTIMER, {{"",DbType::ACCESS_MODE_INPUT, DbType::NEED_DATA, NULL}}
},
{"multimersearch", multimersearch, &localPar.multimersearchworkflow, COMMAND_MAIN,
"Complex level search",
"# Search a single/multiple PDB file against a set of PDB files and get complex level alignments\n"
"Multimer level search",
"# Search a single/multiple PDB file against a set of PDB files and get multimer level alignments\n"
"foldseek multimersearch queryDB targetDB result tmp\n"
"# Format output differently\n"
"foldseek multimersearch queryDB targetDB result tmp --format-output query,target,qstart,tstart,cigar\n"
Expand All @@ -300,8 +300,8 @@ std::vector<Command> foldseekCommands = {
"", NULL, "", "", CITATION_FOLDSEEK_MULTIMER, {{"",DbType::ACCESS_MODE_INPUT, DbType::NEED_DATA, NULL}}
},
{"easy-multimersearch", easymultimersearch, &localPar.easymultimersearchworkflow, COMMAND_EASY,
"Complex level search",
"# Search a single/multiple PDB file against a set of PDB files and get complex level alignments\n"
"Multimer level search",
"# Search a single/multiple PDB file against a set of PDB files and get multimer level alignments\n"
"foldseek easy-multimersearch example/1tim.pdb.gz example/8tim.pdb.gz result tmp\n"
"# Format output differently\n"
"foldseek easy-multimersearch example/1tim.pdb.gz example/8tim.pdb.gz result tmp --format-output query,target,qstart,tstart,cigar\n"
Expand All @@ -324,8 +324,8 @@ std::vector<Command> foldseekCommands = {
{"createmultimerreport", createmultimerreport, &localPar.createmultimerreport, COMMAND_FORMAT_CONVERSION,
"Convert complexDB to tsv format",
"# Create output in tsv format (9 columns): qComplexName.c_str(), tComplexName.c_str(), qChainString.c_str(), tChainString.c_str(), qTMScore, tTMScore, u, t, assId\n"
"# (1,2) identifiers for query and target complex,\n"
"# (3,4) chains of query complex and target complex,\n"
"# (1,2) identifiers for query and target multimers,\n"
"# (3,4) chains of query multimer and target multimer,\n"
"# (5,6) tm score based on query and target residue length,\n"
"# (8,9) u and t,\n"
"# (9) assignment id\n"
Expand All @@ -343,7 +343,7 @@ std::vector<Command> foldseekCommands = {
"", NULL, "", "", CITATION_FOLDSEEK_MULTIMER, {{"",DbType::ACCESS_MODE_INPUT, DbType::NEED_DATA, NULL}}
},
{"expandmultimer", expandmultimer, &localPar.expandmultimer, COMMAND_PREFILTER,
"Re-prefilter to ensure complete alignment between complexes",
"Re-prefilter to ensure complete alignment between multimers",
NULL,
"Woosub Kim <[email protected]>",
"<i:queryDB> <i:targetDB> <i:alignmentDB> <o:prefilterDB>",
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