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fixed pull constraining doing nothing, fixes #825
2011-10-13
Berk Hess
fi
x
ed pull constraining doing nothing, fixes #8
2
5
commit
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commitdiff
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tree
2011-10-06
Berk H
e
ss
fixed segv i
n
parallel repli
c
a exchange
commit
|
commitdiff
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tree
2011-09-19
Berk Hess
added grom
p
p
c
heck for pos
r
es+pcoupl+refcoord_scaling=no
commit
|
commitdiff
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tree
2011-09-15
Berk Hess
mdru
n
-
m
ulti -cpi
now checks
i
f simu
l
ations parts are
.
.
.
commit
|
commitdiff
|
tree
2011-09-13
Berk Hess
fixed grompp issue with decoupling and virtual sites
commit
|
commitdiff
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tree
2011-09-05
Berk Hess
ma
d
e al
l
ocation for LINCS with particle decomposition
.
.
.
commit
|
commitdiff
|
tree
2011-08-29
Berk Hess
fixed incorrect pV ter
m
i
n the
e
n
ergy f
i
le
commit
|
commitdiff
|
tree
2011-08-22
Berk He
s
s
fixed
o
p
e
rat
i
on on closed file s
t
ru
c
ture in gmx
_
rmsd
i
st
.
.
.
commit
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commitdiff
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tree
2011-08-22
Berk Hess
fixed p
o
s
s
ible inf
i
nite
l
oop
w
hen readi
n
g atom types
.
.
.
commit
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commitdiff
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tree
2011-08-15
Berk
H
es
s
f
ixed inco
r
r
ect pointer assignmen
t
in
g
_p
r
o
tonate
commit
|
commitdiff
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tree
2011-08-12
Berk Hess
implemen
t
e
d
full exclusi
o
n support for
t
he
c
ha
r
ge-group
.
.
.
commit
|
commitdiff
|
tree
2011-08-10
Berk Hes
s
rem
o
v
e
d npmenodes
mismatch warning in read_checkpoi
n
t
.
.
.
commit
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commitdiff
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tree
2011-08-10
Berk Hess
rem
o
ved fatal_error for pri
m
e n
u
mb
e
r of nodes when
.
.
.
commit
|
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tree