What’s the best “reproducible” methodology in your opinion?

Can't find the words so heres a diagram, apologies for bad handwriting. Higher energy states that are in between the two conformations you care about are both more combinatorially plentiful, and rarer, and only a few of them matter. mAb CDRs can interconvert on 10s of µs so it matters for those too

Couldn’t agree more! AI id amazing when providing a template for a (difficult) problem but not much more than that. Domain knowledge is still the king

Yeah would never trust it anyway

Would love to see results on protein MD data

Wtf is that

I think it’s fine as it is