New error in workflow version 0.4.7
Hello, I used the new version of the workflow and I got the folloing error:
Error in rule docking: jobid: 110 output: /lustre/project/m2_jgu-smitt/Docking/Mona/m23/result/output/1ITQ/FG/1ITQ.txt_ZINC_FG_FGABRN_0.txt.pdbqt.gz shell: ( mkdir -p /lustre/project/m2_jgu-smitt/Docking/Mona/m23/result/output/1ITQ/FG cd /lustre/project/m2_jgu-smitt/Docking/Mona/m23/result/output/1ITQ/FG cp /lustre/project/m2_jgu-smitt/Docking/Mona/m23/result/receptor/1ITQ.txt . cp /lustre/project/m2_jgu-smitt/Docking/Mona/m23/result/grid/1ITQ_grid.txt . cp /lustre/project/m2_jgu-smitt/Docking/Mona/m23/result/library/ZINC_FG_FGABRN_0.txt . space=$(grep 'spacing' /lustre/project/m2_jgu-smitt/Docking/Mona/m23/GRID/1ITQ.gpf | cut -f2 -d' ') mpirun vinalc --recList 1ITQ.txt --ligList ZINC_FG_FGABRN_0.txt --geoList 1ITQ_grid.txt --granularity $space cd - ) (one of the commands exited with non-zero exit code; note that snakemake uses bash strict mode!) cluster_jobid: 10212912
Error executing rule docking on cluster (jobid: 110, external: 10212912, jobscript: /lustre/miifs01/project/m2_jgu-smitt/Docking/Mona/m23/.snakemake/tmp.naye6nqc/snakejob.docking.110.sh). For error details see the cluster log and the log files of the involved rule(s).
Thank you so much