implicit solvent model for ellipsoid solute cavity
Hanning Chen
chenh... at gmail.com
Thu Sep 2 21:47:30 UTC 2010
Hi, CP2K developers,
Is it possible to implement an implicit solvent model for an ellipsoid
solute cavity in CP2K? After reading Blochl's paper, it seems to me that a
spherical cavity is not required. Is not it?
Thanks.
Hanning
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