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dockerfiles

This repository contains Dockerfiles I accumulated for different purposes.

Some of the images are bare-bone and should maybe be changed when incorporated into analysis pipelines.

The working directory in these containers is generally /data. This can be used as a bindpoint. Downloaded software is generally kept in /software. Some older containers here may however not follow these rules.

The tags given for each container correspond the the available versions of different programs. The Dockerfiles refer to the latest tags.

Currently available containers:

abyss alitv angsd astral augustus bamutil bbmap beast bedops bedtools bibcure biopython_plus blobtools bmge bonito bowtie2 busco cafe cafe-viz clipkit clustalo colord concoct consent cupp deeploc dentist diamond edta eggnog-mapper emboss ete3 fasta3 fastcodeml fastqc fastuniq ffsend flappie flash fmlrc gatk genome-viz get_organelle gnuplot guidance2 hmmer ima2 imagemagick interproscan-wrapper ipyrad iqtree julia jupyter-lab keras kmergenie macse mafft magic-wormhole mamba maxbin mcl metabat metaxa miniBarcoder mitos mosdepth mrbayes multiqc mummer muscle mutt ncbi-blast ncbi-datasets necat nim nimbio_plus norgal novoplasty oma-standalone ont-fast5-api orthofinder paml pal2nal pandoc pass pear phykit phylobayes phylobayes-mpi phylopy phylo-scripts picard pigz purge_haplotigs pyinstaller pyscaf raxml-ng rename rmarkdown repeatmodeler-repeatmasker rphylogenetics samtools scrape_cazy seqtk singularity snakemake spades sra-tools stringtie table2asn tbl2asn tcoffee treeshrink trimal trimmomatic typst ubuntu viralmsa quast quicktree

iqtree

tags: 2.0rc2, 2.0.7

docker run -v $(pwd):/data reslp/iqtree:2.0.7

mrbayes-MPI

tags: 3.2.6

docker run -v $(pwd):/data -it reslp/mrbayes-mpi:3.2.6 /sbin/my_init -- mpirun --allow-run-as-root -np 8 mb /data/alignment.nex

phylo-scripts

tags: latest

docker run reslp/phylo-scripts:latest

Spades

tags: 3.12.0, 3.13.0, 3.15.3

WORKDIR /data

docker pull reslp/spades:3.13.0

trimmomatic

tags: 0.38

docker run -t -v $(pwd):/data reslp/trimmomatic:0.38 trimmomatic PE -phred33 -threads 8 /data/pair1.fq.gz /data/pair2.fq.gz /data/trimmed_pair1.fq.gz /data/unpaired_pair1.fq.gz /data/trimmed_pair2.fq.gz /data/unpaired_pair2.fq.gz HEADCROP:20 ILLUMINACLIP:/data/adapters.fa:2:30:10 LEADING:30 TRAILING:30 SLIDINGWINDOW:4:15 MINLEN:80

or

docker run --user $(id -u):$(id -g) --rm -v $(pwd):/data reslp/trimmomatic trimmomatic

Important: The adapter file is not part of the docker image. It needs to passed together with the mounted directory.

fastqc

tags: 0.11.7

docker run -v $(pwd):/data --rm reslp/fastqc:0.11.7 fastqc /data/illumina_reads_5_R1_trimmed.fq -o /data

docker run --user $(id -u):$(id -g) --rm -v $(pwd):/data reslp/fastqc:0.11.7 fastqc -h

maxbin

tags: 2.2.6

docker pull reslp/maxbin:2.2.6

docker run --rm reslp/maxbin:2.2.6

concoct

tags: 1.1

docker pull reslp/concoct:1.1

docker run --rm reslp/concoct:1.1

A complete example filtering a metagenome. The metagenome.fasta file should be in the current working directory.

docker run -t --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/concoct:1.1 cut_up_fasta.py /data/metagenome.fasta -c 10000 -o 0 --merge_last -b /data/metagenome.fasta_contigs_10K.bed > metagenome.fasta_contigs_10K.fa
docker run -t --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/concoct:1.1 concoct_coverage_table.py /data/metagenome.fasta_contigs_10K.bed /data/metagenome.fasta.bam > concoct_coverage_table.tsv
docker run -t --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/concoct:1.1 concoct --composition_file /data/metagenome.fasta_contigs_10K.fa --coverage_file /data/concoct_coverage_table.tsv -b /data/concoct/metagenome.fasta_concoct --threads 24
docker run --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/concoct:1.1 merge_cutup_clustering.py /data/concoct/metagenome.fasta_concoct_clustering_gt1000.csv > concoct/metagenome.fasta_concoct_clustering_merged.csv
docker run -t --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/concoct:1.1 extract_fasta_bins.py /data/metagenome.fasta /data/concoct/metagenome.fasta_concoct_clustering_merged.csv --output_path /data/concoct/bins

metabat

tags: 2.13

docker run --rm reslp/metabat:2.13

busco

tags: 3.0.2, 4.1.4, 5.2.1

The command for busco >4 is busco instead of run_busco on busco <4.

docker run --rm reslp/busco:3.0.2
docker run --rm reslp/busco:4.1.4

blobtools

tags: 1.1.1

These commands expect that blast results are alread present:

docker run -t --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/blobtools:1.1.1 create -i /data/metagenome.fasta -b /data/metagenome.fasta.bam -t /data/blobtools/metagenome.fasta_diamond_matches_formatted -o /data/blobtools/metagenome.fasta_blobtools
docker run -t --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/blobtools:1.1.1 view -i /data/blobtools/metagenome.fasta_blobtools.blobDB.json -o /data/blobtools/
docker run -t --user $(id -u):$(id -g) -v $(pwd):/data/ --rm reslp/blobtools:1.1.1 plot -i /data/blobtools/metagenome.fasta_blobtools.blobDB.json -o /data/blobtools/

QUAST

tags: 5.0.2

Run QUAST on all fasta files in current directory:

docker run --rm -t -v $(pwd):/data/ reslp/quast:5.0.2 quast.py $(ls -d -1 "*.fasta" | sed 's/^/\/data\//') -o /data/quast --silent

ncbi-blast

tags: 2.9.0, 2.15.0

To create a blast database and run a blastp search: my_sequences.fastaand sequences_to_search.faneed to be in the current working directory. The blastdb will also be created there.

docker run --rm -v $(pwd):/files/ reslp/ncbi-blast:2.9.0 makeblastdb -in /files/my_sequences.fasta -dbtype 'prot' -hash_index -out /files/my_blastdb

docker run --rm -v $(pwd):/files/ reslp/ncbi-blast:2.9.0 blastp -db /files/my_blastdb -query /files/sequences_to_search.fa -outfmt 6 > blast_results.txt

singularity

tags: 3.4.1, 3.6.3

To run the conatiner and to be able to run singularity containers inside it docker needs to be run with privileged mode:

docker run --privileged -it --rm -v $(pwd):/data --entrypoint /bin/bash reslp/singularity:3.4.1

Inside the container it is now possible to run singularity images. For example the singularity image for funannotate (which was downloaded and converted to .sif from Docker Hub).

singularity run funannotate.sif mask -i Trapelia_coarctata_sorted.fas -o Trapelia_coarctata_mask.fas -m repeatmasker

eggnog-mapper

tags: 1.0.3, 2.0.1

docker pull reslp/eggnog-mapper:2.0.1
docker run reslp/eggnog-mapper:2.0.1

ASTRAL

tags: 5.7.1

docker pull reslp/astral:5.7.1
docker run -it --rm reslp/astral:5.7.1 java -jar /ASTRAL-5.7.1/Astral/astral.5.7.1.jar

pal2nal

tags: 14

docker pull reslp/pal2nal:14
docker run -it reslp/pal2nal:14

mafft

tags: 7.464

docker run -it --rm -v $(pwd):/data reslp/mafft:7.464 mafft --auto --quiet /data/OG0000331.fa > OG0000331_aligned.fa

scrape_cazy

tags: 1

Containerized version of a python script to download information from CAZY.org:

docker run -it --rm reslp/scrape_cazy:1
docker run --rm -it -v $(pwd):/data reslp/scrape_cazy:1 scrape_cazy.py -f GH3

deeploc

tags: 1.0

This container needs some things set up properly to work:

  1. Download DeepLoc: https://services.healthtech.dtu.dk/software.php
  2. Change the first line in bin/deeplocto #!/usr/bin/env python
  3. Mind that you correctly use the bindpoints of the container on execution:
docker run --rm -it -v $(pwd)/deeploc-1.0/bin:/external -v $(pwd)/deeploc-1.0/DeepLoc:/usr/lib/python3/dist-packages/DeepLoc -v $(pwd):/data reslp/deeploc:1.0 deeploc -f /data/deeploc-1.0/test.fasta

CONSENT

Correct long reads: https://github.com/morispi/CONSENT

tags: v2.1

docker run --rm -v $(pwd):/corrected reslp/consent:v2.1 CONSENT-correct --in /corrected/Lmin_combined.fasta --out /corrected/Lmin_combined_corrected.fasta --type ONT

fmlrc

Correct long reads: https://github.com/holtjma/fmlrc

tags: v1.0.0

docker run reslp/fmlrc:v1.0.0

biopython_plus

This image should serve as a base environment to execute python scripts which use biopython and scipy. Tag version corresponds to biopython.

tags: 1.77

docker run reslp:biopython_plus:1.77

miniBarcoder

This is a dockerfile for: https://github.com/asrivathsan/miniBarcoder

tags: 5e1dc3b

docker run  --rm -it --entrypoint /bin/bash reslp/minibarcoder:5e1dc3b

metaxa

tags: 2.2

WORKDIR is /data

docker run --rm -it -v $(pwd):/data reslp/metaxa:2.2

phylobayes

tags: 4.1c

WORDIR is /data

docker run --rm -it -v $(pwd):/data reslp/phylobayes:4.1c

phylobayes-mpi

tags: 1.8b, git_dca7bdf, c12c4d7, 3c77656 (commit from Feb 2023)

WORDIR is /data

docker run --rm -it -v $(pwd):/data reslp/phylobayes-mpi:c12c4d7

GUIDANCE2

tags: 2.02

WORDIR is /data

docker run --rm -it -v $(pwd):/data reslp/guidance2:2.02

raxml-ng

tags: 1.0.0, 1.1.0

WORKDIR is /data

docker run --rm -it -v $(pwd):/data reslp/raxml-ng:1.1.0

rmarkdown based on R

The tags versions correspond to the R version.

tags: 3.6.3, 4.0.3

docker run --rm -it -v $(pwd):/data reslp/rmarkdown:3.6.3 Rscript -e "rmarkdown::render('./report.rmd')"

mamba

The Fast Cross-Platform Package Manager (https://github.com/mamba-org/mamba)

This can serve as a base image for things installed using conda and mamba.

tags: 0.5.3, 0.6.0, 0.7.0, 0.15.3, 0.21.1, 0.23.1, 0.25.0, 1.4.1, 1.5.2(broken!)

docker run --rm -it reslp/mamba:1.4.1

abyss

tags: 2.2.5

WORKDIR is /data

docker run --rm -it reslp/abyss:2.2.5

kmergenie

tags: 1.7051

docker run --rm -it reslp/kmergenie:1.7051

ubuntu

This is based on the official ubuntu image and containes build-essential, vim and wget and gdb.

tags: 20.04

docker run --rm -it reslp/ubuntu:20.04

cafe

Software for Computational Analysis of gene Family Evolution

tags: 4.2.1, 5.0.0b2, 5.1.0

WORKDIR /data (5.0.0b2, 5.1.0)

docker run --rm -it reslp/cafe:4.2.1
docker run --rm -it -v $(pwd):/data reslp/cafe:5.0.0b2 cafe

hmmer

tags: 3.1b2

docker run --rm -it -v $(pwd):/data reslp/hmmer:3.1b2 /bin/bash

emboss

tags: 6.6.0

docker run --rm -it -v $(pwd):/data reslp/emboss:6.6.0 /bin/bash

augustus

tags: 3.3.3

docker run --rm -it $(pwd):/data reslp/augustus:3.3.3

clustalo

tags: 1.2.4

docker run --rm -it reslp/clustalo:1.2.4

bedtools

tags: 2.29.2

docker run --rm -it reslp/bedtools:2.29.2

get_organelle

tags: 1.7.1

docker run --rm -it reslp/getorganelle:1.7.1 get_organelle_from_reads.py

samtools

tags: 1.9, 1.11

docker run --rm -it reslp/samtools:1.11

trimal

tags: 1.4.1

docker run --rm -it -v $(pwd):/data reslp/trimal:1.4.1 trimal -in /data/aligned_all_PF00083.fas -out /data/trimmed_all_PF00083.fas -gappyout

table2asn

tags: 20201119, 1.26.678

Program had no good versioning while in beta, till it was released tags are build dates.

docker run --rm -it -v $(pwd):/data reslp/table2asn:1.26.678 table2asn -h

tbl2asn

tags: 25.8

This is the legacy version of the NCBI tool.

docker run --rm -it -v $(pwd):/data reslp/tbl2asn:25.8

flappie

tags: 4de542f

WORKDIR /data

For convenience the flappy container now also includes ont-fast5-api v. 3.1.6.

# see also ont-fast5-api container on how to convert multi-read fast5 (which is the current read type) to single-read fast5.
docker run --rm -it -v $(pwd):/data reslp/flappie:4de542f flappie --help
docker run --rm -it -v $(pwd):/data reslp/flappie:4de542f flappie /data/fast5_single/0/ > 0.fastq
# using ont-fast5-api:
docker run --rm -it -v $(pwd):/data reslp/flappie:4de542f multi_to_single_fast5 -i /data/fast5_pass -s /data/fast5_single -t 4

ont-fast5-api

tags: 3.1.6

# this will convert multi-read fast5 (newer Minion read type) to single-read fast5. See here: https://github.com/nanoporetech/flappie/issues/32
docker run --rm -it -v $(pwd):/data reslp/ont-fast5-api:3.1.6 multi_to_single_fast5 -i /data/fast5_pass -s /data/fast5_single -t 4

mummer

tags: 4.0.0beta2

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/mummer:4.0.0beta2

bonito

tags: 0.3.2

WORKDIR /data

This container works only with CPUs not GPUs. To basecall Minion reads run this:

docker run --rm -i -v $(pwd):/data reslp/bonito:0.3.2 bonito basecaller dna_r9.4.1@v2 --use_openvino --device=cpu /data/fast5_pass 1> basecalls.fasta
docker run --rm -i -v $(pwd):/data reslp/bonito:0.3.2 bonito basecaller dna_r9.4.1@v3 --use_openvino --device=cpu /data/fast5_pass 1> basecalls.fasta
docker run --rm -i -v $(pwd):/data reslp/bonito:0.3.2 bonito basecaller dna_r9.4.1@v2 --use_openvino --device=cpu /data/fast5_pass --fastq 1> basecalls.fastq

interproscan-wrapper

tags: 5.39-77.0, 5.48-83.0

This is a wrapper container for use with interproscan. Interproscan is huge so it can't be properly packed into a container. The tags refer to the tested versions of interproscan which work with this container. The dockerfile provided may not be the same for different tags. For older versions, Ubuntu 18.04 is used as base due to MobiDBs incompatibility with python >3.8.2 (see here: ebi-pf-team/interproscan#147). Newer versions of the container are based on Ubuntu 20.04 which has python 3.8.5. Older versions of interproscan (before 5.39-77.0) may not be compatible because they may have again different requirements.

docker pull reslp/interproscan-wrapper:5.39-77.0

pyscaf

https://github.com/lpryszcz/pyScaf

tags: 0.12a4

WORKDIR /data

docker run -v $(pwd):/data -it --rm reslp/pyscaf:0.12a

edta

Extensive de-novo TE annotator - https://github.com/oushujun/EDTA

tags: 1.9.6, 1.9.9, 2.0.1

WORKDIR /data

This container uses rmblast 2.9.0 to make the conda installed repeatmasker work, version 2.10.0 won't work. Also, for edta to work in singularity, the configure perl script of RepeatMasker needs to be executed again.

docker run --rm -it reslp/edta:1.9.6

bedops

high performance genomic feature operations - https://github.com/bedops/bedops

tags: 2.4.39

WORKDIR /data

docker run -v $(pwd):/data --rm -it reslp/bedops:2.4.39

norgal

Mitochondrial genome assembler - https://bitbucket.org/kosaidtu/norgal/src/master/

tags: 1.0

WORDIR /data

docker run -v $(pwd):/data --rm -it reslp/norgal:1.0 norgal
docker run -v $(pwd):/data --rm -it reslp/norgal:1.0 norgal.py

seqtk

FASTA and FASTQ processing tool - https://github.com/lh3/seqtk

tags: 1.3

WORKDIR /data

docker run -v $(pwd):/data --rm -it reslp/seqtk:1.3 seqtk

sra-tools

The SRA Toolkit and SDK from NCBI is a collection of tools and libraries for using data in the INSDC Sequence Read Archives. - https://github.com/ncbi/sra-tools

tags: 2.20.1, 2.10.9

WORKDIR /data

docker run --rm -it reslp/sra-tools:2.10.9 fastq-dump

quicktree

Fast implementation of the neighbour-joining phylogenetic inference method - https://github.com/khowe/quicktree

tags: 2.5

WORKDIR /data

docker run --rm -it reslp/quicktree:2.5

bbmap

Splice-aware global aligner for DNA and RNA sequencing reads - https://jgi.doe.gov/data-and-tools/bbtools/bb-tools-user-guide/bbmap-guide/

tags: 38.90

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/bbmap:38.90 bbmap.sh

novoplasty

The organelle assembler and heteroplasmy caller - https://github.com/ndierckx/NOVOPlasty

tags: 4.2

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/novoplasty:4.2
docker run --rm -it -v $(pwd):/data reslp/novoplasty:4.2 NOVOPlasty.pl

mitos

MITOS is a tool for the annotation of metazoan mitochondrial genomes. - https://gitlab.com/Bernt/MITOS

tags: 2.0.8, 1.0.5

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/mitos:2.0.8 runmitos.py
docker run --rm -it -v $(pwd):/data reslp/mitos:2.0.8

rphylogenetics

This is an R container with some phylogenetic packages preinstalled. It is based on my rmarkdown container. Packages: ape, phytools, wesanderson, RColorBrewer

tags: 4.0.3 (refers to used R version), 4.0.3-strict-versions (with more strict versioning of R packages)

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/rphylogenetics:4.0.3

Orthofinder

OrthoFinder: phylogenetic orthology inference for comparative genomics

tags: 2.3.3, 2.5.2, 2.5.4, 2.5.5

Note: The version 2.5.4 of orthofinder seems to have a problem with formatting trees. This seems to be related to this. Although in my container the python version is 3.9. Up to stride orthofinder seems to run correctly.

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/orthofinder:2.5.5

Jupyter-Lab

This Jupyter Lab Notebook also has Tensorflow, Scikitlearn, pandas and numpy installed. The tags refer to the tensorflow version.

tags: 2.4.1

To start a server (either jupyter lab or jupyter notebook):

docker run -d --rm -p 8888:8888 reslp/jupyter-tf:2.4.1 jupyter-lab
docker run -d --rm -p 8888:8888 reslp/jupyter-tf:2.4.1

This will return a hash. Run docker logs on that hash to see the access token. eg:

docker logs 406f5662e0a0fb544ed80d95054642e55439f6eb18fcae30487c8488159e36e4

CUPP

CUPP is a new approach for sequence analysis based on the hypothesis that conserved peptide patterns can be used to identify similarities between proteins. - https://www.bioengineering.dtu.dk/english/ResearchNy/Research-Sections/Section-for-Protein-Chemistry-and-Enzyme-Technology/Enzyme-Technology/CUPP

tags: 1.0.14

docker run --rm -it reslp/cupp:1.0.14 python /software/CUPP_v1.0.14/CUPPprediction.py --help

ima2

IM is a program, written with Rasmus Nielsen, for the fitting of an isolation model with migration to haplotype data drawn from two closely related species or populations. - https://bio.cst.temple.edu/~tuf29449/software

tags: 8.27.12

WORKDIR /data

docker run --rm -it reslp/ima2:8.27.12

alitv

AliTV is a program to visualize whole genome alignments: https://alitv.readthedocs.io/en/latest/manual.html

tags: d06bd45

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/alitv:d06bd45

speedtest-cli

This a command line program which performs network speedtests: https://www.speedtest.net/de/apps/cli

tags: 2.1.2, 2.1.3

docker run --rm reslp/speedtest-cli:2.1.3 speedtest-cli --csv >> /home/pi/speedtest/speedtest_data.txt

bowtie2

Bowtie 2 is an ultrafast and memory-efficient tool for aligning sequencing reads to long reference sequences. - https://github.com/BenLangmead/bowtie2

tags: 2.3.5

WORKDIR /data

docker run reslp/bowtie2:2.3.5 bowtie2

fastuniq

an ultrafast de novo duplicates removal tool for paired short DNA sequences - https://sourceforge.net/projects/fastuniq/

tags: 1.1

WORKDIR /data

docker run --rm -it reslp/fastuniq:1.1 fastuniq

flash

Fast Length Adjustment of SHort reads - https://ccb.jhu.edu/software/FLASH/

tags: 1.2.11

WORKDIR /data

docker run --rm -it reslp/flash:1.2.11 flash

bamutil

Programs that perform operations on SAM/BAM files, all built into a single executable, bam. - https://genome.sph.umich.edu/wiki/BamUtil

tags: 1.0.15

WORKDIR /data

docker run --rm -it reslp/bamutil:1.0.15 bam

picard

Java tools for working with NGS data in the BAM format - http:https://broadinstitute.github.io/picard/

tags: 2.18.7

WORKDIR /data

docker run --rm -it reslp/picard:2.18.7 picard

gatk

Genome analysis toolkit - https://gatk.broadinstitute.org/hc/en-us

tags: 3.8

WORKDIR /data

Hint: Executable name is gatk3 NOT gatk!

docker run --rm -it reslp/gatk:3.8 gatk3

angsd

ANGSD is a software for analyzing next generation sequencing data - http:https://www.popgen.dk/angsd/index.php/ANGSD

tags: 0.935

docker run --rm -it reslp/angsd:0.935 angsd

purge_haplotigs

Pipeline to help with curating heterozygous diploid genome assemblies - https://bitbucket.org/mroachawri/purge_haplotigs/src/master/

tags: 1.1.1

WORKDIR /data

docker run --rm -it $(pwd):/data reslp/purge_haplotigs:1.1.1

fasta3

The FASTA package - protein and DNA sequence similarity searching and alignment programs

tags: 36.3.8

WORKDIR /data

Hint: All the programs of the FASTA3 package have 36 appended to the end of their name. So eg. glsearch is glsearch36 in this container.

docker run --rm -it -v $(pwd):/data reslp/fasta3:36.3.8 glsearch36 /data/query.fas /data/subset.fasta

macse

MACSE: Multiple Alignment of Coding SEquences Accounting for Frameshifts and Stop Codons.

WORKDIR /data

tags: 1.2, 2.05

docker run --rm -it reslp/macse:1.2 macse
docker run --rm -it reslp/macse:2.05 macse -h

julia

julia - The Julia Programming Language

This container includes julia and a number of packages from BioJulia and packages for data handling, plotting and report generation.

tags: 1.6.3

WORDKIR /data

docker run --rm -it reslp/julia:1.6.3 julia

nim

Nim programming lanuage

tags: 1.4.8, 1.6.6, 1.6.12

docker run --rm -it reslp/nim:1.6.6

mosdepth

fast BAM/CRAM depth calculation for WGS, exome, or targeted sequencing (https://github.com/brentp/mosdepth)

tags: 0.3.3

docker run --rm -it reslp/mosdepth:0.3.3

viralmsa

Reference-guided multiple sequence alignment of viral genomes (https://github.com/niemasd/ViralMSA)

Note: There is an offical container, but it lacks several dependencies and does not work (tested March 21, 2022) hence the container here which largely builds on the official version.

tags: 1.1.20

WORKDUT /data

docker run --rm -it reslp/viralmsa:1.1.20 ViralMSA.py -h

dentist

Close assembly gaps using long-reads at high accuracy. (https://github.com/a-ludi/dentist)

Note: This container also includes snakemake 6.0.2 so it is possible to run the whole dentist pipeline within the container.

tags: 3.0.0

docker run --rm -it reslp/dentist:3.0.0 dentist

muscle

Multiple sequence alignment with top benchmark scores scalable to thousands of sequences. (https://github.com/rcedgar/muscle)

tags: 5.1

WORKDIR /data

docker run --rm -it reslp/muscle:5.1 muscle

necat

NECAT is an error correction and de-novo assembly tool for Nanopore long noisy reads. (https://github.com/xiaochuanle/NECAT)

tags: 0.0.1_update20200803

WORKDIR /data

The script in the container is called necat not necat.pl.

docker run --rm -it reslp/necat:0.0.1_update20200803 necat

colord

A versatile compressor of third generation sequencing reads. (https://github.com/refresh-bio/colord)

tags: 1.1.0

WORKDIR /data

docker run --rm -it reslp/colord:1.1.0 colord

bmge

BMGE (Block Mapping and Gathering with Entropy) is a program that selects regions in a multiple sequence alignment that are suited for phylogenetic inference. (https://bioweb.pasteur.fr/packages/pack@[email protected]/)

tags: 1.12

WORKDIR /data

docker run --rm -it reslp/bmge:1.12 bmge

ete3

A Python framework for the analysis and visualization of trees. - http:https://etetoolkit.org/

tags: 3.1.2

Hint: External programs don't work due to the omnipresent bug in ete3: etetoolkit/ete#444

WORKDIR /data

docker run --rm -it reslp/ete3:3.1.2

dendropy

DendroPy Phylogenetic Computing Library - https://dendropy.org/

tags: 4.5.2

WORKDIR /data

docker run --rm -it reslp/dendropy:4.5.2

phylopy

A container with dendropy, ete3 and pandas based on python 3.7.

tags: 1

WORKDIR /data

docker run --rm -it reslp/phylopy:1

ffsend

Easily and securely share files from the command line. A fully featured Firefox Send client. https://github.com/timvisee/ffsend

tags: 0.2.76

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/ffsend:0.2.76 ffsend upload myfile.txt

magic-wormhole

Get things from one computer to another, safely. https://github.com/magic-wormhole/magic-wormhole

tags: 0.12.0

WORKDIR /data

docker run --rm -it reslp/magic-wormhole:0.12.0

pandoc

A universal document converter. https://pandoc.org/

tags: 2.18, 3.1.3

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/pandoc:2.18 pandoc test.md -o test.pdf

beast

Bayesian Evolutionary Analysis by Sampling Trees - https://github.com/CompEvol/beast2

tags: 2.6.7

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/beast:2.6.7

pigz

Parallel implementation of gzip

tags: 2.6

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/pigz:2.6

rename

Rename files

tags: 1.10-1

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/rename:1.10-1 

pyinstaller

PyInstaller bundles a Python application and all its dependencies into a single package.

tags: 5.1, 6.1

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/pyinstaller:5.1

pear

PEAR is an ultrafast, memory-efficient and highly accurate pair-end read merger

tags: 0.9.6

WORKDIR /data

docker run --rm -it reslp/pear:0.9.6

taxonkit

A Practical and Efficient NCBI Taxonomy Toolkit - https://github.com/shenwei356/taxonkit

tags: 0.12.0

WORKDIR /data

docker run --rm -it reslp/taxonkit:0.12.0

exonerate

Exonerate - A generic tool for pairwise sequence comparison / alignment

tags: 2.4.0

docker run --rm -it reslp/exonerate:2.4.0

oma-standalone

Standalone version of the OMA Orthology Matrix - https://omabrowser.org/oma/home/

tags: 2.5.0

WORKDIR /data

docker run --rm -it reslp/oma-standalone:2.5.0 OMA

repeatmodeler-repeatmasker

This container contains RepeatModeler and Repeatmasker including all dependencies (hopefully).

The tag consists of the repeatmodeler version and the repeatmasker version:

tags: 2.0.3-4.1.3

WORKDIR /data

docker run --rm -it reslp/repeatmodeler-repeatmasker:2.0.3-4.1.3

mutt

Open source CLI email client

tags: 3.2.6

docker run --rm -it --user $(id -u):$(id -g) -v /etc/passwd:/etc/passwd:ro -v /etc/group:/etc/group:ro -v $HOME/:/home/$USER/ -e HOME=/home/$USER reslp/mutt:3.2.6 mutt

PAML

Phylogenetic Analysis by Maximum Likelihood - https://github.com/abacus-gene/paml

tags: 4.9 (conda version, comes with biopython1.81 scipy), 4.10.6

WORKDIR /data

docker run --rm -it reslp/paml:4.10.6

pass

the standard unix password manager - https://www.passwordstore.org/

HOME /data

GnuPG and pass needs to be configured correctly for this to work.

# linux
docker run --rm -it -v $HOME:/data --user $(id -u):$(id -g) reslp/pass:1.7.4

# mac
docker run --rm -it -v $HOME:/data reslp/pass:1.7.4

snakemake

The Snakemake workflow management system - https://snakemake.readthedocs.io/en/stable/

tags: 6.0.2

docker run --rm -it reslp/snakemake:6.0.2

nimbio_plus

My own nimbio library together with nim, glob, ggplotnim, clapfn, nimx

tags: 0.0.1, 0.0.2, 0.0.3

docker run --rm -it reslp/nimbio_plus:0.0.2

fastcodeml

FastCodeML is a software to infer positive selection along positions of a protein coding gene using the Branch-Site model of evolution - https://bioweb.pasteur.fr/packages/pack@[email protected]

tags: 1.1.0

docker run --rm -it reslp/fastcodeml:1.1.0 fast

diamond

Accelerated BLAST compatible local sequence aligner. - https://github.com/bbuchfink/diamond

tags: 0.9.22, 2.0.7, 2.1.7

WORKDIR /data

docker run --rm -it reslp/diamond:2.0.7

MCL

MCL - a cluster algorithm for graphs - https://github.com/micans/mcl

tags: 14.137, 22.282

WORKDIR /data

docker run --rm -it reslp/mcl:14.137

cafe-viz

Tools for visualizing cafe output. Currently includes:
cafeplotter and CAFE_Fig
https://github.com/moshi4/CafePlotter
https://github.com/LKremer/CAFE_fig

tags: 1.0

WORKDIR /data

docker run --rm -it reslp/cafe-viz:1.0 cafeplotter
docker run --rm -it reslp/cafe-viz:1.0 python3 /usr/bin/CAFE_fig.py

phykit

a UNIX shell toolkit for processing and analyzing multiple sequence alignments and phylogenies - https://github.com/jlsteenwyk/phykit

tags: 1.11.15

WORKDIR /data

docker run --rm -it reslp/phykit:1.11.15 phykit -h

genome-viz

a python script to visualize genome assemblies - https://github.com/reslp/genomics

tags: 1.0

docker run --rm -it reslp/genome-viz:1.0 genome_viz.py

bibcure

Bibcure helps in boring tasks by keeping your bibfile up to date and normalized...also allows you to easily download all papers inside your bibtex. - https://github.com/bibcure/bibcure

tags: 0.3.0

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/bibcure:0.3.0 doi2bib -i literature_only_dois.txt -o bib.txt

amplicon_sorter

Sorts amplicons from Nanopore sequencing data based on similarity - https://github.com/avierstr/amplicon_sorter

Tags are based on git commits, since there is no versioning. tags: 33f0d38

docker run --rm -it -v $(pwd):/data reslp/amplicon_sorter:33f0d38 amplicon_sorter.py

typst

A new markup-based typesetting system that is powerful and easy to learn. - https://github.com/typst/typst

tags: 0.7.0, 0.9.0

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/typst:0.9.0 typst watch /data/document.typ

gnuplot

Gnuplot is a portable command-line driven graphing utility for Linux, OS/2, MS Windows, OSX, VMS, and many other platforms. - http:https://www.gnuplot.info/

tags: 5.4.9

docker run --rm -it reslp/gnuplot:5.4.9

ncbi-acc-download

Download files from NCBI Entrez by accession - https://github.com/kblin/ncbi-acc-download/

tags: 0.2.8

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/ncbi-acc-download:0.2.8 ncbi-acc-download

stringtie

Transcript assembly and quantification for RNA-Seq - https://github.com/gpertea/stringtie

tags: 2.2.1

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/stringtie:2.2.1 stringtie

imagemagick

ImageMagick is a free, open-source software suite, used for editing and manipulating digital images. - https://imagemagick.org/index.php

tags: 7.1.0_46

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/imagemagick:7.1.0_46 convert

tectonic

Tectonic is a modernized, complete, self-contained TeX/LaTeX engine, powered by XeTeX and TeXLive. - https://tectonic-typesetting.github.io/en-US/

tags: 0.14.1

WORKDIR /data

docker run --rm -it -v $(pwd):/data reslp/tectonic:0.14.1 tectonic

multiqc

Aggregate results from bioinformatics analyses across many samples into a single report - https://multiqc.info/

tags: 1.6, 1.17

WORKDIR /data

docker run --rm -it reslp/multiqc:1.17 multiqc

keras

These containers come with the deep-learing library KERAS together with several additional libraries such as pandas, numpy, sci-kit and scikit-learn, matplotlib etc.

tags: 3.0.0-torch, 3.0.0-tf

docker run --rm -it reslp/keras:3.0.0-tf

treeshrink

TreeShrink is an algorithm for detecting abnormally long branches in one or more phylogenetic trees. - https://github.com/uym2/TreeShrink

tags: 1.3.9

WORKDIR /data

docker run --rm -it reslp/treeshrink:1.3.9 run_treeshrink -h

ipyrad

Interactive assembly and analysis of RAD-seq data sets - https://github.com/dereneaton/ipyrad

tags: 0.9.93

WORKDIR /data

docker run --rm -it reslp/ipyrad:0.9.93 ipyrad

ncbi-datasets

NCBI Datasets command-line clients - https://www.ncbi.nlm.nih.gov/datasets/docs/v2/download-and-install/

tags: 16.25.0

docker run --rm -it reslp/ncbi-datasets:16.25.0 datasets

tcoffee

A collection of tools for Computing, Evaluating and Manipulating Multiple Alignments of DNA, RNA, Protein Sequences and Structures. - https://github.com/cbcrg/tcoffee

tags: 11.0.8, v.13.46.0.919e8c6b

docker run --rm -it reslp/tcoffee:13.46.0.919e8c6b t_coffee

clipkit

Alignment trimming software for phylogenetics. - https://github.com/jlsteenwyk/clipkit

tags: 2.3.0

docker run --rm -it reslp/clipkit:2.3.0 clipkit

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