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Fix for MSVC linking and release-build OpenMM plugin dir.
2010-05-30
Szila
r
d
Pal
l
Fix for MSV
C
linking and re
l
ease-build O
p
enMM plugin
.
.
.
commit
|
commitdiff
|
tree
2010-05-26
Szilard Pall
Fixed some
compiler wa
r
inigs, minor bug
s
and
d
ocumenta
t
ion
.
.
.
commit
|
commitdiff
|
tree
2010-05-19
Szilard Pall
Merge
b
ran
c
h '
m
aster' of gi
t
@gi
t
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-19
Szilard Pall
fixed the PM
E
tol
e
ranc
e
"adjustment"
f
or OpenMM
commit
|
commitdiff
|
tree
2010-05-12
S
z
il
a
rd Pall
Merge branch
'ma
s
ter' of git@gi
t
.
gr
o
m
a
cs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-12
S
zil
a
rd Pall
Fix in
o
penmm_wrapper which makes it work with MSVC
.
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pal
l
fix
e
d signal han
d
ling i
n
md_ope
n
mm
commit
|
commitdiff
|
tree
2010-05-12
Szil
a
rd Pall
Merge br
a
nc
h
'master' of git@git
.
gromacs
.
org
:
gromac
s
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
minor
f
i
xes i
n
doc
u
mentation
+
s
o
me
d
ebuggin
g
code
.
.
.
commit
|
commitdiff
|
tree
2010-05-12
Szilar
d
Pall
a
dded os-s
p
ecific def
i
nes from cm
a
ke requi
r
ed
b
y memtestG80
commit
|
commitdiff
|
tree
2010-05-10
Szi
l
ard Pall
MSVC fix
for gmx_parallel_
3
dff
t
.
c
commit
|
commitdiff
|
tree
2010-05-10
S
z
ilard Pall
only
issue o
p
enmm co
n
s
t
rints warni
n
g if constrainsta
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pa
l
l
Merg
e
b
r
an
c
h 'maste
r
'
of git@git
.
gromacs
.
o
r
g:gro
m
acs
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pall
t
emporary
fix for compilation error with GMX_OPENMM=ON
commit
|
commitdiff
|
tree
2010-05-07
S
z
ilard Pall
Merge bra
n
ch 'master' of
git@git
.
g
rom
a
cs
.
o
r
g
:
gr
o
macs
commit
|
commitdiff
|
tree
2010-05-07
Sz
i
lard Pall
Merge branch 'ma
s
te
r
'
of git@g
i
t
.
gromac
s
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-07
Szil
a
rd P
a
ll
added
gromacs file
h
eaders to
t
he Open
M
M-related files
commit
|
commitdiff
|
tree
2010-05-07
S
zilard Pall
minor fi
x
e
s
,
d
ocumentatio
n
and sli
g
ht API change in
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
S
zilar
d
Pa
l
l
minor upd
a
te
s
to F
i
n
d
Git and FindOp
e
nMM
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pall
u
pdated Fi
n
dCUDA to versi
o
n from
c
make 2
.
8
.
1 for CUDA
.
.
.
commit
|
commitdiff
|
tree
2010-04-20
S
z
ilard P
a
l
l
Mer
g
e branch 'master' of g
i
t@git
.
grom
a
cs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-04-20
S
zila
r
d Pa
l
l
doxygen comments for
t
he Open
M
M
part
commit
|
commitdiff
|
tree
2010-04-16
Szi
l
ard Pa
l
l
added docu
m
entation f
o
r the open
m
m
_
wrapper
commit
|
commitdiff
|
tree
2010-04-16
Szilard Pall
formatti
n
g
fix of
o
p
e
nmm wrapp
e
r -
groma
c
sified th
e
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
S
z
i
lard Pall
cleaned
up
a
b
unch op mess in
d
o
_
m
d
_
o
pe
n
mm
commit
|
commitdiff
|
tree
2010-04-13
S
zilard
P
all
bug
f
ix
for do_md
_
open
m
m - was always pulling data from
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pall
f
i
xed
timing bu
g
in do_md_openmm
commit
|
commitdiff
|
tree
2010-04-13
Sz
i
lard Pall
add
e
d some more suppo
r
ted GPUs (
h
igh-
e
nd mobile and
.
.
.
commit
|
commitdiff
|
tree
2010-04-06
Szilar
d
Pall
Mer
g
e branch
'
master
'
of git@g
i
t
.
gro
m
acs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-04-06
S
z
ilard P
a
ll
now g_bar lo
o
k
s for l
a
mbda only in the
l
ast directory
.
.
.
commit
|
commitdiff
|
tree
2010-04-04
Szilard P
a
l
l
Fixed g_bar
bug
i
n
l
a
mbda value parsing
from path
.
commit
|
commitdiff
|
tree
2010-03-29
S
z
ilard Pall
fi
x
ed gmxGenerateVersionI
n
fo
.
cmake to p
r
oduce 8
d
igit
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
The cmake
d
evelop
m
ent
info
r
mation ge
n
erating
wo
r
ks
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
ad
d
ed FindGit
.
cmake script
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
fix
for gmxGe
n
era
t
eVersi
o
nInfo
.
cmake, now work
s
with
.
.
.
commit
|
commitdiff
|
tree
2010-03-25
Szilard Pa
l
l
fixed USE_V
E
R
SION_H Cmake option
commit
|
commitdiff
|
tree
2010-03-18
Szil
a
rd
Pall
Merg
e
branch 'master' of git
@
git
.
gro
m
acs
.
org:g
r
omac
s
commit
|
commitdiff
|
tree
2010-03-18
Szilard Pa
l
l
f
i
xed
th
e
problem of v
e
rsion
.
c not
be
i
n
g
built a
t
th
e
.
.
.
commit
|
commitdiff
|
tree
2010-03-18
Szilard
P
all
added mis
s
i
n
g VERSION prefix to _
g
mx_ver_stri
n
g
commit
|
commitdiff
|
tree
2010-03-16
Szilard Pal
l
fix for
genve
r
sion
.
sh
to recog
n
ize
t
he g
i
t://
.
.
.
/gromacs
.
.
.
commit
|
commitdiff
|
tree
2010-03-16
Szilard P
a
l
l
Merge
b
ranch 'mast
e
r' of git@git
.
grom
a
cs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-03-16
S
z
ilard Pall
Cmake
implem
e
ntation to ge
n
e
rate
d
eve
l
opm
e
n
t
bui
l
d
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
OpenMM b
u
ild not dep
e
ndent on f
f
tw anymore
commit
|
commitdiff
|
tree
2010-03-11
S
z
ilard Pall
fixe
d
mdrun ver
b
osity wit
h
O
penMM build
commit
|
commitdiff
|
tree
2010-03-11
Szila
r
d Pall
fixed a missing com
m
a a
n
d a ty
p
o in openmm
_
wr
a
pper
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
Del
e
te src/kernel/do_md_
o
penmm_nop
a
tch
.
h, it's not
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
S
z
il
a
rd Pal
l
Minor cleanup, some rearrang
a
men
t
s, and commenti
n
g
.
commit
|
commitdiff
|
tree
2010-03-11
Szila
r
d
Pall
Reverted stu
p
id c
h
ange in CMal
e
Lists
.
txt
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
Renamed md_openm
m
i
nto
ope
n
mm_wrapper, an
d
do
_
m
d
_openmm
.
.
.
commit
|
commitdiff
|
tree
2010-01-28
Szila
r
d P
a
ll
Fixed dea
d
loc
k
o
c
curing in gmx_f
a
tal
.
c: introduced
.
.
.
commit
|
commitdiff
|
tree
