Development of GROMOS-Compatible Parameter Set for Simulations of Chalcones and Flavonoids.Chalcones and flavonoids constitute a large family of plant secondary metabolites that have been explored as a potential source of novel pharmaceutical products.  So the current work developed a new parameter set for MD simulations of these compounds' main scaffolds under GROMOS force field. 
GROMOS
Development of GROMOS-Compatible Parameter Set for Simulations of Chalcones and Flavonoids.Chalcones and flavonoids constitute a large family of plant secondary metabolites that have been explored as a potential source of novel pharmaceutical products.  So the current work developed a new parameter set for MD simulations of these compounds' main scaffolds under GROMOS force field. 
GROMOS