tidymol-python
Tools for sorting and comparing molden files and extracting data from them, aimed at computational chemistry workflows.
Tools for sorting and comparing molden files and extracting data from them, aimed at computational chemistry workflows.
Turns a RELAX NG schema into browsable HTML documentation. Started by Tom Schraitle, who supervised me at the time; I worked on it for my final project as a Fachinformatiker für Anwendungsentwicklung.