[sharp-discuss] Reason for Jump in correlation coefficient on|E|**2 during last cycle of phase improvement
hari jayaram
harijay at gmail.com
Wed Sep 23 17:08:03 CEST 2009
I was wondering what the reason is for the Jump in the correlation
coefficient on |E|**2 values between the last but one cycle and the last
cycle.
For eg I have the values
*Cycle 112* : Radius = 4.0000 I(1) = 0.3747 I(2) = 0.3755 I(3)
= 0.3700 I(4) = *0.6883*
Resolution = 4.0000 Solv. Frac. = 0.500 Flip = -1.0000
*Cycle 113* : Radius = 4.0000 I(1) = 0.3746 I(2) = 0.2467 I(3)
= 0.2420 I(4) = 0.8994
Resolution = 4.0000 Solv. Frac. = 0.500 Flip = 0.0000
Is solvent flipping only done after cycle 112 as indicated by Flip = -1
going to Flip 0
Thanks for your help
Hari
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