Fig. 6: MLMD simulations from tilted and gas phase 4PG configurations.
From: A solution for 4-propylguaiacol hydrodeoxygenation without ring saturation

Evolution of structure changes in MLMD simulation leading to the formation of flat 4PG configuration, starting from (a) tilted 4PG configuration at 120 °C and (b) gas phase 4PG configuration at 220 °C in the THF atmosphere.