A new method for determining the interfacial molecules and characterizing the surface roughness in computer simulations. Application to the liquid-vapor interface of water. - Lívia B. Pártay; György Hantal; Pál Jedlovszky; Árpád Vincze; George Horvai (J. Comput. Chem., 2008)

Pytim: A python package for the interfacial analysis of molecular simulations. - Marcello Sega; György Hantal; Balázs Fábián; Pál Jedlovszky (J. Comput. Chem., 2018)