An EBNet-funded POC awarded to Dr Tao Lyu, the PFAS WG Lead, looked at the use of molecular docking and dynamics simulations to investigate interactions between enzymes and PFAS compounds, with the goal of helping to elucidate potential mechanisms for PFAS biodegradation and providing tools to bridge the gap between theoretical exploration and experimental validation
EBNet is delighted to present a short animation explaining the concept behind the work, produced by Dr Lyu and his team as an output from the POC project. The animation is available HERE on EBNet’s Youtube Channel.
See also Summary Report POC202413 Molecular docking and molecular dynamics simulations for assessing biodegradation of PFAS.
And for more on this lively topic area see other recent posts.
