Background#R##N#The graph-theoretical analysis of molecular networks has a long tradition in chemoinformatics. As demonstrated frequently, a well designed format to encode chemical structures and structure-related information of organic compounds is the Molfile format. But when it comes to use modern programming languages for statistical data analysis in Bio- and Chemoinformatics, R as one of the most powerful free languages lacks tools to process Molfile data collections and import molecular network data into R.
['Martin Grabner', 'Kurt Varmuza', 'Matthias Dehmer']
RMol: a toolset for transforming SD/Molfile structure information into R objects