Pessoas:

Laboratorios:

Relacionados:

Bruno Araujo Cautiero Horta Charlles Rubber de Almeida Abreu Frederico Wanderley Tavares Sérgio de Paula Machado

Palavras-chave

molecular dynamics simulation carlo simulation studies complexo molecular dynamic complexe equilibrium equation state thermodynamic molecular dynamics interaction high pressure quimica adsorption model sistema ligante liquid gromos force field hobr monte carlo acid metodo liquido fluid compound properties modelagem molecular