biod.pnpi.spb.ru
/
alexxy
/
gromacs.git
/ blobdiff
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
raw
| inline |
side by side
Merge origin/release-2019 into release-2020
[alexxy/gromacs.git]
/
src
/
gromacs
/
gmxana
/
cmat.cpp
diff --git
a/src/gromacs/gmxana/cmat.cpp
b/src/gromacs/gmxana/cmat.cpp
index cde327414c01eff198371fcab431a11d423d2111..07368d9d41b2c5ddff94daa131bd7edcd54e5d96 100644
(file)
--- a/
src/gromacs/gmxana/cmat.cpp
+++ b/
src/gromacs/gmxana/cmat.cpp
@@
-227,7
+227,7
@@
void low_rmsd_dist(const char* fn, real maxrms, int nn, real** mat, const gmx_ou
}
}
- fp = xvgropen(fn, "RMS Distribution", "RMS (nm)", "
a.u.
", oenv);
+ fp = xvgropen(fn, "RMS Distribution", "RMS (nm)", "
counts
", oenv);
for (i = 0; (i < 101); i++)
{
fprintf(fp, "%10g %10d\n", i / fac, histo[i]);