Mercurial > repos > galaxy-australia > alphafold2
diff docker/alphafold/scripts/download_uniprot.sh @ 1:6c92e000d684 draft
"planemo upload for repository https://github.com/usegalaxy-au/galaxy-local-tools commit a510e97ebd604a5e30b1f16e5031f62074f23e86"
author | galaxy-australia |
---|---|
date | Tue, 01 Mar 2022 02:53:05 +0000 |
parents | |
children |
line wrap: on
line diff
--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/docker/alphafold/scripts/download_uniprot.sh Tue Mar 01 02:53:05 2022 +0000 @@ -0,0 +1,55 @@ +#!/bin/bash +# +# Copyright 2021 DeepMind Technologies Limited +# +# Licensed under the Apache License, Version 2.0 (the "License"); +# you may not use this file except in compliance with the License. +# You may obtain a copy of the License at +# +# http://www.apache.org/licenses/LICENSE-2.0 +# +# Unless required by applicable law or agreed to in writing, software +# distributed under the License is distributed on an "AS IS" BASIS, +# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. +# See the License for the specific language governing permissions and +# limitations under the License. +# +# Downloads, unzips and merges the SwissProt and TrEMBL databases for +# AlphaFold-Multimer. +# +# Usage: bash download_uniprot.sh /path/to/download/directory +set -e + +if [[ $# -eq 0 ]]; then + echo "Error: download directory must be provided as an input argument." + exit 1 +fi + +if ! command -v aria2c &> /dev/null ; then + echo "Error: aria2c could not be found. Please install aria2c (sudo apt install aria2)." + exit 1 +fi + +DOWNLOAD_DIR="$1" +ROOT_DIR="${DOWNLOAD_DIR}/uniprot" + +TREMBL_SOURCE_URL="ftp://ftp.ebi.ac.uk/pub/databases/uniprot/current_release/knowledgebase/complete/uniprot_trembl.fasta.gz" +TREMBL_BASENAME=$(basename "${TREMBL_SOURCE_URL}") +TREMBL_UNZIPPED_BASENAME="${TREMBL_BASENAME%.gz}" + +SPROT_SOURCE_URL="ftp://ftp.ebi.ac.uk/pub/databases/uniprot/current_release/knowledgebase/complete/uniprot_sprot.fasta.gz" +SPROT_BASENAME=$(basename "${SPROT_SOURCE_URL}") +SPROT_UNZIPPED_BASENAME="${SPROT_BASENAME%.gz}" + +mkdir --parents "${ROOT_DIR}" +aria2c "${TREMBL_SOURCE_URL}" --dir="${ROOT_DIR}" +aria2c "${SPROT_SOURCE_URL}" --dir="${ROOT_DIR}" +pushd "${ROOT_DIR}" +gunzip "${ROOT_DIR}/${TREMBL_BASENAME}" +gunzip "${ROOT_DIR}/${SPROT_BASENAME}" + +# Concatenate TrEMBL and SwissProt, rename to uniprot and clean up. +cat "${ROOT_DIR}/${SPROT_UNZIPPED_BASENAME}" >> "${ROOT_DIR}/${TREMBL_UNZIPPED_BASENAME}" +mv "${ROOT_DIR}/${TREMBL_UNZIPPED_BASENAME}" "${ROOT_DIR}/uniprot.fasta" +rm "${ROOT_DIR}/${SPROT_UNZIPPED_BASENAME}" +popd