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Commit 521e06b7 authored by Giovanni Bussi's avatar Giovanni Bussi
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Fixed regtest failing for numerical errors on new clang compilers

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#! FIELDS time j1 j2 j3 j4 j5 j6 j7 #! FIELDS time j1 j2 j3 j4 j5 j6 j7
0.000000 10.5935 3.9915 1.1185 4.5355 0.4759 3.2683 2.4940 0.000000 10.593 3.991 1.119 4.535 0.476 3.268 2.494
10.000000 0.4341 5.2427 8.2510 2.6140 2.1636 1.4050 3.0609 10.000000 0.434 5.243 8.251 2.614 2.164 1.405 3.061
20.000000 8.7739 5.8798 0.5531 2.5260 0.8015 5.7921 3.2281 20.000000 8.774 5.880 0.553 2.526 0.801 5.792 3.228
30.000000 11.0298 4.5288 0.8065 1.9460 2.2785 5.6556 3.8554 30.000000 11.030 4.529 0.807 1.946 2.278 5.656 3.855
40.000000 11.4096 5.5963 1.2854 6.4978 0.8623 5.7078 3.9404 40.000000 11.410 5.596 1.285 6.498 0.862 5.708 3.940
50.000000 10.8848 7.5652 7.4284 1.8964 2.4459 0.1991 0.4854 50.000000 10.885 7.565 7.428 1.896 2.446 0.199 0.485
60.000000 9.9558 6.5077 3.3126 2.0712 1.0280 5.8000 3.9920 60.000000 9.956 6.508 3.313 2.071 1.028 5.800 3.992
70.000000 10.8136 6.7461 1.5468 2.8648 0.8674 5.4530 3.7263 70.000000 10.814 6.746 1.547 2.865 0.867 5.453 3.726
80.000000 9.1018 4.9667 2.8858 1.8865 1.2836 5.3631 3.9995 80.000000 9.102 4.967 2.886 1.887 1.284 5.363 4.000
90.000000 3.4876 7.4668 8.8033 2.4603 1.1766 5.2204 3.9656 90.000000 3.488 7.467 8.803 2.460 1.177 5.220 3.966
100.000000 3.5324 4.8932 11.4783 2.0514 2.2295 5.3712 3.8787 100.000000 3.532 4.893 11.478 2.051 2.229 5.371 3.879
...@@ -51,5 +51,5 @@ TEMP=300 ...@@ -51,5 +51,5 @@ TEMP=300
PRINT ... PRINT ...
ARG=j1,j2,j3,j4,j5,j6,j7 ARG=j1,j2,j3,j4,j5,j6,j7
STRIDE=10 FILE=colvar STRIDE=10 FILE=colvar
FMT=%8.4f FMT=%8.3f
... PRINT ... PRINT
...@@ -11,14 +11,14 @@ ...@@ -11,14 +11,14 @@
90.000000 3.487607 7.466811 8.803344 2.460335 1.176599 5.220447 3.965647 90.000000 3.487607 7.466811 8.803344 2.460335 1.176599 5.220447 3.965647
100.000000 3.532403 4.893175 11.478312 2.051419 2.229474 5.371195 3.878713 100.000000 3.532403 4.893175 11.478312 2.051419 2.229474 5.371195 3.878713
#! FIELDS time j1 j2 j3 j4 j5 j6 j7 #! FIELDS time j1 j2 j3 j4 j5 j6 j7
0.000000 10.5935 3.9915 1.1185 4.5355 0.4759 3.2683 2.4940 0.000000 10.593 3.991 1.119 4.535 0.476 3.268 2.494
10.000000 0.4341 5.2427 8.2510 2.6140 2.1636 1.4050 3.0609 10.000000 0.434 5.243 8.251 2.614 2.164 1.405 3.061
20.000000 8.7739 5.8798 0.5531 2.5260 0.8015 5.7921 3.2281 20.000000 8.774 5.880 0.553 2.526 0.801 5.792 3.228
30.000000 11.0298 4.5288 0.8065 1.9460 2.2785 5.6556 3.8554 30.000000 11.030 4.529 0.807 1.946 2.278 5.656 3.855
40.000000 11.4096 5.5963 1.2854 6.4978 0.8623 5.7078 3.9404 40.000000 11.410 5.596 1.285 6.498 0.862 5.708 3.940
50.000000 10.8848 7.5652 7.4284 1.8964 2.4459 0.1991 0.4854 50.000000 10.885 7.565 7.428 1.896 2.446 0.199 0.485
60.000000 9.9558 6.5077 3.3126 2.0712 1.0280 5.8000 3.9920 60.000000 9.956 6.508 3.313 2.071 1.028 5.800 3.992
70.000000 10.8136 6.7461 1.5468 2.8648 0.8674 5.4530 3.7263 70.000000 10.814 6.746 1.547 2.865 0.867 5.453 3.726
80.000000 9.1018 4.9667 2.8858 1.8865 1.2836 5.3631 3.9995 80.000000 9.102 4.967 2.886 1.887 1.284 5.363 4.000
90.000000 3.4876 7.4668 8.8033 2.4603 1.1766 5.2204 3.9656 90.000000 3.488 7.467 8.803 2.460 1.177 5.220 3.966
100.000000 3.5324 4.8932 11.4783 2.0514 2.2295 5.3712 3.8787 100.000000 3.532 4.893 11.478 2.051 2.229 5.371 3.879
...@@ -52,5 +52,5 @@ TEMP=300 ...@@ -52,5 +52,5 @@ TEMP=300
PRINT ... PRINT ...
ARG=j1,j2,j3,j4,j5,j6,j7 ARG=j1,j2,j3,j4,j5,j6,j7
STRIDE=10 FILE=colvar STRIDE=10 FILE=colvar
FMT=%8.4f FMT=%8.3f
... PRINT ... PRINT
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