‘Molecular descriptors’ database for IL/ IL-FFs

A virtual database of ILs (at least 5000) will be built according to similarities in molecular structures and the resulting physical properties among them. The results will be used in the screening of first generation ILs (WP2). Molecular descriptors for 'hypothetical' IL-FF will describe the relationship between the structure. This will aid selecting suitable IL-FF for WP5 and WP3.