Modeling the electrostatic potential of asymmetric lipopolysaccharide membranes the MEMPOT algorithm implemented in DelPhi

von Dias, Roberta P
Veröffentlicht in: Journal of computational chemistry (2014)

DFT study of the full catalytic cycle for the propene hydroformylation catalyzed by a heterobimetallic HPt(SnCl3)(PH3)2 model catalyst

von da Silva, Júlio C S
Veröffentlicht in: Journal of computational chemistry (2010)