Brad's Research
From Henkelman Group
Finding free energy dividing surfaces
NS vs PS vs hybrid ...looks like the "hybrid" sampling is the winner here. (boo FFS)
Translocation of a knotted polypeptide
Throwing ropes over mountain passes in the Dark...
APBS -Adaptive Poisson-Boltzmann solver
Rh(100) diffusion: NS and PS sampling
Flux-position and Parity:comparing reactive flux in irreversible and reversible ensembles.
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