working microcanonical for CA2+ protein

[unres4.git] / PARAM / cation_param.parm

diff --git a/PARAM/cation_param.parm b/PARAM/cation_param.parm
new file mode 100644 (file)
index 0000000..c6bf926
--- /dev/null
+++ b/PARAM/cation_param.parm
@@ -0,0 +1,11 @@
+ 23.0  1.868 
+ 24.0  0.793
+ 39.0  2.650
+ 40.0  1.713
+ 35.5  2.470
+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
+0        -70.79 1499.0  3.0   0.1      3.5   0.05
+0        -93.13 1975.0  3.0   0.1      3.5   0.01
+wc        wdip wquad1 wquad2 epsilonLJ r0lJ sigm