Revisiting the single-saddle model of the β-relaxation of supercooled liquids

This dataset is associated with "<em>Revisiting the single-saddle model of the β-relaxation of supercooled liquids</em>", by D. Coslovich and A. Ikeda. It includes data and workflow to allow for the replication of the analysis and plots of the manuscript. To reproduce the workflow on a minimal dataset, download and extract the package ssm.tar.gz, then execute <pre><code class="language-bash">./make test</code></pre> If the workflow fails because of missing dependencies, download the docker image ssm-docker.tar.gz, load the image and execute the same command within the container. Make sure you have at least 5 Gb of free space on your disk if you use the package, and 15 Gb if you use the docker image. See project.pdf below for full details about the workflow. <strong>Changelog</strong>: 1.0.1: logger fails quietly if bc is missing, add Dockerfile to package 1.0.0: initial submission