Wow this is impressive. One of those tech bio advances that is both expected and yet still very surprising when you see it working for real.
Dynamics: folding & binding of an intrinsically disordered peptide to its protein receptor via an intermediate state.View quoted post on X
A 5 milliseconds simulation would take >10 GPU years with MD simulation.
At 5 microsecond steps, BioEmu2 needs 40 minutes on the same GPU – a >100,000 x speedup!