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Minor patch
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JLittlef committed Mar 19, 2024
1 parent c0f0ecf commit b57c69e
Showing 1 changed file with 2 additions and 2 deletions.
4 changes: 2 additions & 2 deletions main.nf
Original file line number Diff line number Diff line change
Expand Up @@ -20,7 +20,7 @@ process OpenmmMinimise {
publishDir "${params.resultsDir}/openmm-minimise/", pattern: "*folded.pdb", mode: 'copy'
publishDir "${params.resultsDir}/openmm-minimise/", pattern: "data.csv", mode: 'copy'
input:
path fixed_pdbs
tuple path fixed_pdbs
output:
path '*_unfolded.pdb', emit: unfolded_pdbs
path '*_folded.pdb', emit: folded_pdbs
Expand Down Expand Up @@ -50,7 +50,7 @@ process OutputData {
workflow {
inpath_ch = channel.fromPath("${params.inputFile}")
incsv_ch = channel.fromPath("${params.inputCsv}")
PdbfixerMutants(incsv_ch, inpath_ch) | flatten
PdbfixerMutants(incsv_ch, inpath_ch)
OpenmmMinimise(PdbfixerMutants.out.fixed_pdbs)
OutputData(PdbfixerMutants.out.csv_reformat, OpenmmMinimise.out.data)
}
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