[gmx-users] vdwradii.dat - where do the values come from?

João M. Damas jmdamas at itqb.unl.pt
Wed Jun 10 14:55:15 CEST 2009

Hi there GMX users,

Does anyone know where do the van der waals radii values that are in the
vdwradii.dat come from? I've searched the archives and David said once that
he didn't recall where they were token from. If there is no information
whatsoever of where do they come from and since it would be difficult to
introduce other element's van der waals radii consistent to the current
ones, why keep using them?


João M. Damas
PhD Student
Protein Modelling Group
ITQB-UNL, Oeiras, Portugal
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