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Computation of neutron and X-ray reflectivity curves from molecular dynamics simulations

GitLab integration for Invenio. This module is work in progress.

This is a fork of https://github.com/yigbt/deepFPlearn that is regularly synced. This primary use of this repository is the creation of (docker) images with gitlab workflows at HZDR.

This repository contains docker compose deployment files for the whole software stack behind the Helmholtz knowledge graph, work from the unHIDE initiative. Deployment includes containers for the harvesters and utility, the API, SOLR, Virtuoso, Web Frontend as well as for nginx and letsencrypt. More information on the unHIDE initiative, which was launched by the Helmholtz Metadata Collaboration (HMC), you can find under https://docs.unhide.helmholtz-metadaten.de.

⚠ 🚧 Development of custom builds for the Power (ppc64le) and 64-Bit ARM (arm64) architectures has been moved to gitlab.com/hzdr.

The provided scripts in scriptspod let the turnkey service (https://github.com/sfu-ireceptor/turnkey-service-php) run with podman instead of docker on operating systems where docker is not available like Centos 8.