Hello again, as far as I have seen from the jmol documentation there is no support for coloring a molecular surface according the molecular lipophilic potential (MLP).
Chime provided a method to do that, probably by assigning a lipophilicity value to each atom, but I'm ignorant of the detail of the computation. Anyway, the lipophilicity values for the atoms did not have to be provided with the file for the molecule. (using the keywords "color [surfacename] mlp") Is there a way to do the same in Jmol? Did I just overlook it in the documentation? Dr. Reinhold Störmann Bioorganic Chemistry Center for Environmental Research & Technology (UFT) Leobener Str. D-28359 Bremen ------------------------------------------------------------------------- This SF.net email is sponsored by: Microsoft Defy all challenges. Microsoft(R) Visual Studio 2008. http://clk.atdmt.com/MRT/go/vse0120000070mrt/direct/01/ _______________________________________________ Jmol-users mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/jmol-users
