COSMO-SMD Initialization (regarding solvent accessible surface area)


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Forum Regular
6:47:18 AM PST - Tue, Jan 5th 2016
Hi Tom,

Please also try compiling with the Intel 15 compiler if possible.
As I mentioned earlier, turning on the flags that Edo suggested will help pin this down further if there is a subtle issue with the code.

Thanks.

Best,
-Niri