Arguably the simplest way to use rust from python – no manual compilation step, setup work or binding code required. rustimport provides a simple CLI, makes sure the compiled extension stays up to ...

Sabbadin, D.; Moro, S. Supervised Molecular Dynamics (SuMD) as a Helpful Tool to Depict GPCR-Ligand Recognition Pathway in a Nanosecond Time Scale. J. Chem. Inf ...