Use bioemu:v2 tag to force k8s to pull fixed image with UID 1000 user
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6
main.nf
6
main.nf
@@ -13,7 +13,7 @@ params.temperature = 300
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params.n_clusters = 5
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params.n_clusters = 5
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process GENERATE_STRUCTURE_1 {
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process GENERATE_STRUCTURE_1 {
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container 'harbor.cluster.omic.ai/omic/bioemu:latest'
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container 'harbor.cluster.omic.ai/omic/bioemu:v2'
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publishDir "${params.outdir}/${params.complex_name}/protein1", mode: 'copy'
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publishDir "${params.outdir}/${params.complex_name}/protein1", mode: 'copy'
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input:
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input:
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@@ -41,7 +41,7 @@ process GENERATE_STRUCTURE_1 {
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}
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}
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process GENERATE_STRUCTURE_2 {
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process GENERATE_STRUCTURE_2 {
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container 'harbor.cluster.omic.ai/omic/bioemu:latest'
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container 'harbor.cluster.omic.ai/omic/bioemu:v2'
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publishDir "${params.outdir}/${params.complex_name}/protein2", mode: 'copy'
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publishDir "${params.outdir}/${params.complex_name}/protein2", mode: 'copy'
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input:
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input:
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@@ -69,7 +69,7 @@ process GENERATE_STRUCTURE_2 {
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}
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}
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process CALCULATE_BINDING {
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process CALCULATE_BINDING {
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container 'harbor.cluster.omic.ai/omic/bioemu:latest'
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container 'harbor.cluster.omic.ai/omic/bioemu:v2'
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publishDir "${params.outdir}/${params.complex_name}/analysis", mode: 'copy'
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publishDir "${params.outdir}/${params.complex_name}/analysis", mode: 'copy'
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input:
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input:
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@@ -11,7 +11,7 @@ docker {
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}
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}
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process {
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process {
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container = 'harbor.cluster.omic.ai/omic/bioemu:latest'
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container = 'harbor.cluster.omic.ai/omic/bioemu:v2'
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cpus = 2
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cpus = 2
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memory = '8 GB'
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memory = '8 GB'
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}
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}
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