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gapseq
gapseq
gapseq performs informed prediction and analysis of bacterial metabolic pathways and produces gap-filled genome-scale metabolic models from genome sequences.
License
Free to use and open source under GNU GPLv3.
Available
- Roihu: 2.1.0, via the
bio-appsmodule.
Usage
gapseq is part of the bio-apps collection on Roihu. Load the bio-apps module tree and then the gapseq module:
Reference sequence database
gapseq requires a reference sequence database for sequence searches. If a shared
database is not available on Roihu, download it to a writable location such as your
project's /scratch directory.
For bacterial genomes:
For archaeal genomes, replace Bacteria with Archaea.
Specify the same database directory with -D when running gapseq.
Running gapseq
The full pipeline (pathway prediction, network building and gap-filling) can be run on
a genome with the doall subcommand:
Individual steps (find, find-transport, draft, fill) can also be run
separately. gapseq analyses can be computationally heavy and should be run as batch
jobs:
#!/bin/bash
#SBATCH --job-name=gapseq
#SBATCH --account=<project>
#SBATCH --output=output_%j.txt
#SBATCH --error=errors_%j.txt
#SBATCH --partition=small
#SBATCH --time=12:00:00
#SBATCH --nodes=1
#SBATCH --ntasks=1
#SBATCH --cpus-per-task=8
#SBATCH --mem-per-cpu=4G
module load bio-apps/v202603
module load gapseq/2.1.0
DB=/scratch/<project>/gapseq_db
gapseq doall \
-K "$SLURM_CPUS_PER_TASK" \
-D "$DB" \
genome.fna.gz
Replace <project> with your CSC project (for example project_2001234).
See creating a batch job script for Roihu for more information about running batch jobs.