cp2k/tools/docker/scripts/install_misc.sh
2023-06-08 10:46:10 +02:00

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#!/bin/bash -e
# author: Ole Schuett
# install Ubuntu packages
apt-get update -qq
apt-get install -qq --no-install-recommends \
ca-certificates \
libpython3-stdlib \
python3 \
python3-pip \
python3-wheel \
python3-setuptools \
python3-dev \
build-essential \
gfortran \
cmake \
golang \
unzip \
wget
rm -rf /var/lib/apt/lists/*
# install python packages
pip3 install --quiet \
numpy \
matplotlib \
requests \
types-lxml \
types-requests \
mypy==1.3.0
# download inputs for minimax_to_fortran_source.py
wget -q https://www.cp2k.org/static/downloads/1_xData.zip
echo "7be2e56d83d0cb17683bbc8ab85dae1dc9a9c937e1dc1bad1514857938e687cb 1_xData.zip" | sha256sum --check
#EOF