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small changes in cation cation interactions and wham correction
[unres4.git]
/
PARAM
/
cation_param.parm
diff --git
a/PARAM/cation_param.parm
b/PARAM/cation_param.parm
index
c6bf926
..
bc91684
100644
(file)
--- a/
PARAM/cation_param.parm
+++ b/
PARAM/cation_param.parm
@@
-1,8
+1,8
@@
- 23.0 1.868
- 24.0 0.793
- 39.0 2.650
- 40.0 1.713
- 35.5 2.470
+ 23.0 1.868 1
+ 24.0 0.793 2
+ 39.0 2.650 1
+ 40.0 1.713 2
+ 35.5 2.470 -1
7
-1381.06 282.2 -203.7 3.0 0.1 3.5 0.12
-1426.87 -98.92 -2454.0 3.0 0.1 3.5 0.02