Figure 1
From: The Quixote project: Collaborative and Open Quantum Chemistry data management in the Internet age
Quixote architecture and conversion workflow. The user instructs Lensfield2 to convert output files of different computational chemistry codes into semantically rich CML files. The conversion is performed by JUMBO-Converters following the hints provided in the dictionaries and templates. The generated CML files are then transferred to one or more local and remote chem# repositories using a RESTful web API. The user can search and browse those repositories with a web browser, and can also manipulate and visualize the CML files with Avogadro.