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lines changed Original file line number Diff line number Diff line change @@ -36,17 +36,21 @@ process FOLDSEEK_SEARCH {
3636 }
3737
3838 """
39+ export MAX_SEQS=\$ (echo "${ params.foldseek_max_seqs ?: 100} ")
40+ export ALIGNMENT_TYPE=\$ (echo "${ params.foldseek_alignment_type ?: 2} ")
41+ export THREADS=\$ (echo "${ task.cpus} ")
42+
3943 /usr/local/bin/foldseek_avx2 easy-search \\
4044 ${ structure} \\
4145 ${ db_path} /afdb \\
4246 ${ meta.id} _foldseek_results.tsv \\
4347 tmp_foldseek \\
44- -e ${ evalue } \\
45- --max-seqs ${ max_seqs } \\
46- -s ${ sensitivity } \\
47- -c ${ coverage } \\
48- --alignment-type ${ alignment_type } \\
49- --threads ${ task.cpus } \\
48+ -e ${ params.foldseek_evalue ?: 0.001 } \\
49+ --max-seqs \$ MAX_SEQS \\
50+ -s ${ params.foldseek_sensitivity ?: 9.5 } \\
51+ -c ${ params.foldseek_coverage ?: 0.0 } \\
52+ --alignment-type \$ ALIGNMENT_TYPE \\
53+ --threads \$ THREADS \\
5054 --gpu 1 \\
5155 --prefilter-mode 1
5256
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