gutSMASH is a tool that has been developed to systematically evaluate the metabolic potential of anaerobic bacteria in the gut by predicting both known and novel anaerobic metabolic gene clusters (MGCs) from the gut microbiome. The gutSMASH detection rules have been validated using a curated dataset.
This application requires a graphical connection using NX
Allocate an interactive session and run the program.
Sample session (user input in bold):
[user@biowulf]$ sinteractive --cpus-per-task 4 salloc.exe: Pending job allocation 46116226 salloc.exe: job 46116226 queued and waiting for resources salloc.exe: job 46116226 has been allocated resources salloc.exe: Granted job allocation 46116226 salloc.exe: Waiting for resource configuration salloc.exe: Nodes cn3144 are ready for job [user@cn3144 ~]$ module load gutsmash [user@cn3144 ~]$ run_gutsmash.py --cpus $SLURM_CPUS_PER_TASK --minimal $GUTSMASH_HOME/test/Streptomyces_coelicolor.gbk [user@cn3144 ~]$ exit salloc.exe: Relinquishing job allocation 46116226 [user@biowulf ~]$
Create a batch input file (e.g. gutsmash.sh). For example:
#!/bin/bash set -e module load gutsmash run_gutsmash --cpus $SLURM_CPUS_PER_TASK --minimal $GUTSMASH_HOME/test/Streptomyces_coelicolor.gbk
Submit this job using the Slurm sbatch command.
sbatch [--cpus-per-task=#] [--mem=#] gutsmash.sh
Create a swarmfile (e.g. gutsmash.swarm). For example:
run_gutsmash.py --cpus $SLURM_CPUS_PER_TASK --minimal sample1.gbk run_gutsmash.py --cpus $SLURM_CPUS_PER_TASK --minimal sample2.gbk run_gutsmash.py --cpus $SLURM_CPUS_PER_TASK --minimal sample3.gbk
Submit this job using the swarm command.
swarm -f gutsmash.swarm [-g #] [-t #] --module gutsmashwhere
-g # | Number of Gigabytes of memory required for each process (1 line in the swarm command file) |
-t # | Number of threads/CPUs required for each process (1 line in the swarm command file). |
--module gutsmash | Loads the gutSMASH module for each subjob in the swarm |