correction to 4P energy and csa examples

[unres.git] / examples / unres / CSA / 4P / outputs / 1l2y_csa.out_GB001

diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa.out_GB001 b/examples/unres/CSA/4P/outputs/1l2y_csa.out_GB001
index d41eab4..4b41fa2 100644 (file)
--- a/examples/unres/CSA/4P/outputs/1l2y_csa.out_GB001
+++ b/examples/unres/CSA/4P/outputs/1l2y_csa.out_GB001
@@ -139,29 +139,16 @@ CSA calculations calculation.
 Conformations will be energy-minimized.
 ********************************************************************************
 
-Waiting for     0.1443 sec
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- Finishing minim_jlee - signal           0  from master
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+ Finishing minim_jlee - signal           0  from master
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@@ -169,8 +156,6 @@ Waiting for     0.0000 sec
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@@ -181,12 +166,12 @@ Waiting for     0.0000 sec
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@@ -194,17 +179,18 @@ Waiting for     0.0000 sec
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@@ -212,11 +198,11 @@ Waiting for     0.0000 sec
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@@ -226,24 +212,26 @@ Waiting for     0.0000 sec
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@@ -252,9 +240,9 @@ Waiting for     0.0000 sec
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@@ -264,12 +252,8 @@ Waiting for     0.0000 sec
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@@ -277,18 +261,7 @@ Waiting for     0.0000 sec
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@@ -297,8 +270,8 @@ Waiting for     0.0000 sec
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@@ -312,10 +285,8 @@ Waiting for     0.0000 sec
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@@ -324,33 +295,24 @@ Waiting for     0.0000 sec
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@@ -360,22 +322,18 @@ Waiting for     0.0000 sec
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@@ -390,23 +348,23 @@ Waiting for     0.0000 sec
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@@ -418,28 +376,25 @@ Waiting for     0.0000 sec
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@@ -620,32 +568,28 @@ Waiting for     0.0000 sec
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@@ -677,12 +619,13 @@ Waiting for     0.0000 sec
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@@ -706,28 +649,27 @@ Waiting for     0.0000 sec
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+Waiting for     0.0501 sec
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 Waiting for     0.0001 sec
 Waiting for     0.0000 sec
@@ -872,10 +810,9 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0673 sec
 Waiting for     0.0000 sec
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-Waiting for     0.0997 sec
-Waiting for     0.0001 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
@@ -883,14 +820,14 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
-Waiting for     0.0001 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.1007 sec
 Waiting for     0.0000 sec
-Waiting for     0.0724 sec
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+Waiting for     0.0001 sec
 Waiting for     0.0000 sec
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@@ -899,7 +836,7 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
-Waiting for     0.1016 sec
+Waiting for     0.0706 sec
 Waiting for     0.0000 sec
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@@ -912,10 +849,11 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0611 sec
 Waiting for     0.0000 sec
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-Waiting for     0.0917 sec
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+Waiting for     0.0002 sec
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@@ -924,10 +862,10 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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+Waiting for     0.0701 sec
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-Waiting for     0.0998 sec
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@@ -939,12 +877,10 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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+Waiting for     0.0726 sec
 Waiting for     0.0000 sec
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-Waiting for     0.0002 sec
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 Waiting for     0.0000 sec
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@@ -952,6 +888,7 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
+Waiting for     0.0934 sec
 Waiting for     0.0000 sec
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@@ -960,9 +897,10 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0001 sec
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-Waiting for     0.0980 sec
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+Waiting for     0.0698 sec
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@@ -971,8 +909,9 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0002 sec
+Waiting for     0.0765 sec
 Waiting for     0.0000 sec
-Waiting for     0.0568 sec
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@@ -984,8 +923,8 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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+Waiting for     0.1698 sec
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-Waiting for     0.0741 sec
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@@ -994,14 +933,9 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0002 sec
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-Waiting for     0.0000 sec
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-Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0910 sec
 Waiting for     0.0000 sec
 Waiting for     0.0002 sec
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@@ -1009,14 +943,11 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0002 sec
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-Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0001 sec
 Waiting for     0.0000 sec
-Waiting for     0.1006 sec
-Waiting for     0.0002 sec
 Waiting for     0.0000 sec
+Waiting for     0.0553 sec
 Waiting for     0.0000 sec
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@@ -1027,11 +958,9 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0006 sec
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-Waiting for     0.0768 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0509 sec
 Waiting for     0.0000 sec
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@@ -1045,15 +974,9 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0000 sec
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-Waiting for     0.0000 sec
-Waiting for     0.0984 sec
-Waiting for     0.0000 sec
 Waiting for     0.0001 sec
+Waiting for     0.0930 sec
+Waiting for     0.0002 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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@@ -1065,23 +988,21 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0982 sec
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-Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0002 sec
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+Waiting for     0.2531 sec
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+Waiting for     0.0001 sec
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-Waiting for     0.1002 sec
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+Waiting for     0.0039 sec
 Waiting for     0.0000 sec
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@@ -1094,8 +1015,8 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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+Waiting for     0.1046 sec
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-Waiting for     0.0928 sec
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@@ -1115,20 +1036,6 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
-Waiting for     0.0002 sec
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 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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@@ -1136,9 +1043,8 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
-Waiting for     0.0002 sec
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+Waiting for     0.0949 sec
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@@ -1150,11 +1056,12 @@ Waiting for     0.0000 sec
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+Waiting for     0.0001 sec
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+Waiting for     0.0456 sec
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-Waiting for     0.0613 sec
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@@ -1163,6 +1070,7 @@ Waiting for     0.0000 sec
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+Waiting for     0.0314 sec
 Waiting for     0.0000 sec
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@@ -1173,8 +1081,11 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0001 sec
 Waiting for     0.0000 sec
+Waiting for     0.0002 sec
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+Waiting for     0.1053 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
@@ -1185,6 +1096,7 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
+Waiting for     0.0952 sec
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 Waiting for     0.0000 sec
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@@ -1193,11 +1105,12 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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-Waiting for     0.0800 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
+Waiting for     0.1000 sec
+Waiting for     0.0001 sec
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@@ -1205,7 +1118,6 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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-Waiting for     0.0821 sec
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@@ -1213,7 +1125,7 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
-Waiting for     0.0002 sec
+Waiting for     0.0997 sec
 Waiting for     0.0000 sec
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@@ -1221,11 +1133,10 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
-Waiting for     0.0848 sec
 Waiting for     0.0000 sec
-Waiting for     0.0001 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0966 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
@@ -1235,8 +1146,8 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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-Waiting for     0.0920 sec
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+Waiting for     0.0890 sec
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 Waiting for     0.0000 sec
@@ -1248,6 +1159,7 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0943 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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@@ -1257,6 +1169,7 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
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 Waiting for     0.0000 sec
+Waiting for     0.0533 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0002 sec
@@ -1264,8 +1177,6 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0060 sec
-Waiting for     0.1746 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
@@ -1274,20 +1185,7 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0000 sec
-Waiting for     0.0777 sec
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-Waiting for     0.0000 sec
-Waiting for     0.0000 sec
-Waiting for     0.0573 sec
+Waiting for     0.0769 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
@@ -1297,10 +1195,12 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0001 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0695 sec
 Waiting for     0.0000 sec
+Waiting for     0.0652 sec
+Waiting for     0.0025 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
@@ -1323,14 +1223,9 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0682 sec
-Waiting for     0.0000 sec
-Waiting for     0.0000 sec
-Waiting for     0.0000 sec
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-Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.0006 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
@@ -1340,10 +1235,10 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0937 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
+Waiting for     0.1003 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
@@ -1351,15 +1246,12 @@ Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0002 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.0001 sec
-Waiting for     0.0000 sec
 Waiting for     0.0000 sec
 Waiting for     0.0000 sec
-Waiting for     0.1158 sec
+Waiting for     0.0429 sec
  Finishing minim_jlee - signal           0  from master
- End of minim, proc           1 time    1417783922.9683061     
+ End of minim, proc           1 time    1417786241.3893340     
 CG processor   1 is finishing work.
- Total wall clock time   108.86786389350891       sec
+ Total wall clock time   97.900413036346436       sec