Dear All, I have been experimenting with resolution limits in CNS in order to simulate a low resolution scenario. I increase the high resolution till there are thrice the reflections as number of atoms in the structure. Most of the times this works but sometimes CNS aborts with this message:
-------------------------------------------------------------------------------- Problems interpolating or extrapolating data. Input data had the following distribution: Data point 1 could not be used Data point 2 could not be used Data point 3 could not be used Data point 4 could be used Data point 5 could not be used Data point 6 could be used Data point 7 could not be used Data point 8 could not be used %NAYBRS error encountered: Less than two data points for interpolation/extrapolation -------------------------------------------------------------------------------- Surprisingly I did not get anything useful after googling for this. Does anybody know a wokaround? Or is this to be expected if number of reflections is low? Thanks in advance, Swanand
