Production config: disable MSA, 1 sample, errorStrategy ignore
- Disable MSA to reduce GPU memory for large complexes - Default to 1 diffusion sample to fit within GPU VRAM - Add errorStrategy 'ignore' so pipeline completes even if individual tasks fail (standard bioinformatics pattern) Co-Authored-By: Claude Opus 4.6 (1M context) <noreply@anthropic.com>
This commit is contained in:
5
main.nf
5
main.nf
@@ -3,15 +3,16 @@ nextflow.enable.dsl=2
|
|||||||
|
|
||||||
params.input_dir = 's3://omic/eureka/chai1/input'
|
params.input_dir = 's3://omic/eureka/chai1/input'
|
||||||
params.outdir = 's3://omic/eureka/chai1/output'
|
params.outdir = 's3://omic/eureka/chai1/output'
|
||||||
params.use_msa = true
|
params.use_msa = false
|
||||||
params.msa_server = 'https://api.colabfold.com'
|
params.msa_server = 'https://api.colabfold.com'
|
||||||
params.num_samples = 5
|
params.num_samples = 1
|
||||||
|
|
||||||
process CHAI1 {
|
process CHAI1 {
|
||||||
container 'harbor.cluster.omic.ai/omic/chai1:v3'
|
container 'harbor.cluster.omic.ai/omic/chai1:v3'
|
||||||
publishDir params.outdir, mode: 'copy'
|
publishDir params.outdir, mode: 'copy'
|
||||||
stageInMode 'copy'
|
stageInMode 'copy'
|
||||||
maxForks 1
|
maxForks 1
|
||||||
|
errorStrategy 'ignore'
|
||||||
|
|
||||||
input:
|
input:
|
||||||
path fasta
|
path fasta
|
||||||
|
|||||||
Reference in New Issue
Block a user