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Merge branch 'release-4-5-patches' into release-4-6
[alexxy/gromacs.git]
/
share
/
top
/
charmm27.ff
/
aminoacids.rtp
diff --git
a/share/top/charmm27.ff/aminoacids.rtp
b/share/top/charmm27.ff/aminoacids.rtp
index 7eef837af42ea2867b6f1623e35cf152378fb15b..d24ef05e5173956f03aa56c6cba390f58c9a9345 100644
(file)
--- a/
share/top/charmm27.ff/aminoacids.rtp
+++ b/
share/top/charmm27.ff/aminoacids.rtp
@@
-1657,6
+1657,17
@@
OH2 H1
OH2 H2
+[ HO4 ]
+; TIP4P
+ [ atoms ]
+ OW OWT4 0.00 0
+ HW1 HWT4 0.52 0
+ HW2 HWT4 0.52 0
+ MW MWT4 -1.04 0
+ [ bonds ]
+ OW HW1
+ OW HW2
+
[ SOD ]
[ atoms ]
SOD SOD 1.00 0