2018-05-222018-05-222007-07OLIVEIRA, Anselmo E. de. Aplicações tecnológicas da modelagem molecular. Revista Processos Químicos, Anápolis, v. 1, p. 9-13, jul. 2007.http://repositorio.bc.ufg.br/handle/ri/15047Not only mathematical models have been used to validate hypotheses made from experimental data, but also to develop new materials. In Chemical process technology the product quality is determined at the micro and nano level. A product with a desired property must be investigated by molecular modeling methods for both structure and function. Polymers, catalysis and nanomaterial science researchers have been using theoretical methodologies based on quantum theory to develop state-of-the-art technologies.porAcesso AbertoQuímica computacionalNovos materiaisCatálisePolímerosComputational chemistryMaterial designCatalysisPolymersArtigo1981-8521