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Fix in openmm_wrapper which makes it work with MSVC.
2010-05-12
Sz
i
lard Pall
F
ix in
openmm_wrapper whic
h
makes
it w
o
r
k
w
ith MSVC
.
commit
|
commitdiff
|
tree
2010-05-12
S
zilard Pall
fixed signal
handling in md_op
e
nmm
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
M
er
g
e branch 'master' of
g
it@g
i
t
.
gromacs
.
org
:
g
roma
c
s
commit
|
commitdiff
|
tree
2010-05-12
Szilard
Pal
l
m
inor fixes in
documentation
+ some debugging code
.
.
.
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pa
l
l
added os
-
s
p
ecif
i
c
def
i
nes fro
m
cmak
e
required by memtestG80
commit
|
commitdiff
|
tree
2010-05-10
Szilard Pall
MSVC fix
f
or gm
x
_
p
arallel_3
d
fft
.
c
commit
|
commitdiff
|
tree
2010-05-10
Szila
r
d Pa
l
l
onl
y
i
ssue openmm con
s
trints warning if
c
onstra
i
nsta
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szilard
P
a
ll
Merge
b
r
anch 'master' of git@git
.
gromacs
.
org:g
r
oma
c
s
commit
|
commitdiff
|
tree
2010-05-07
S
zilard Pall
temporary fix for com
p
ila
t
io
n
e
rro
r
with GMX_
O
PENMM=ON
commit
|
commitdiff
|
tree
2010-05-07
Sz
i
l
ard Pall
Me
r
ge branch 'master' of g
i
t@git
.
gromacs
.
org:gromac
s
commit
|
commitdiff
|
tree
2010-05-07
Szi
l
ard Pall
M
e
rge branch
'
m
ast
e
r'
of git@git
.
gromacs
.
org
:
gromacs
commit
|
commitdiff
|
tree
2010-05-07
S
z
i
lard Pall
added gromacs file headers to the OpenMM-relate
d
files
commit
|
commitdiff
|
tree
2010-05-07
Szil
a
r
d
P
a
l
l
mi
n
or fi
x
es, documentation and slight API change in
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Sz
i
lard Pall
minor updates to FindGi
t
and FindOpenM
M
commit
|
commitdiff
|
tree
2010-05-07
Szil
a
rd Pall
updated
F
indCUDA t
o
v
e
rsio
n
f
r
om
cmake 2
.
8
.
1 for CUDA
.
.
.
commit
|
commitdiff
|
tree
2010-04-20
S
zilard Pall
Merge branc
h
'
ma
s
ter' of git@git
.
gromacs
.
org
:
grom
a
c
s
commit
|
commitdiff
|
tree
2010-04-20
S
z
ila
r
d Pall
d
oxygen
comments for the
O
p
e
nMM part
commit
|
commitdiff
|
tree
2010-04-16
Szilard
P
a
l
l
add
e
d docum
e
nt
a
tion
f
or the
openmm_wrapper
commit
|
commitdiff
|
tree
2010-04-16
Szilard Pall
formatting fi
x
of openmm wr
a
pper - gromac
s
ified the
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pall
cleaned up a bu
n
ch
op mess in do_md_openmm
commit
|
commitdiff
|
tree
2010-04-13
Szil
a
r
d
Pall
bugfix for do_md_openmm - was al
w
ays pulling data fro
m
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pall
fi
x
e
d
timing bug
i
n do_m
d
_openmm
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pall
add
e
d some more
suppor
t
ed G
P
Us
(high-end mobi
l
e and
.
.
.
commit
|
commitdiff
|
tree
2010-04-06
Szilard
Pall
Merge
b
ranch
'
mast
e
r' of git@git
.
gromacs
.
org:gro
m
acs
commit
|
commitdiff
|
tree
2010-04-06
Sz
i
lard Pall
now g_b
a
r looks for lambda only in t
h
e last direct
o
ry
.
.
.
commit
|
commitdiff
|
tree
2010-04-04
Szilard
Pall
Fixed g_b
a
r bug in lambda value par
s
ing from path
.
commit
|
commitdiff
|
tree
2010-03-29
Szilard Pall
fi
x
ed gmx
G
enerat
e
V
e
r
sionInfo
.
cmake to pro
d
uce 8
digit
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
T
he c
m
ake developm
e
n
t i
n
forma
t
ion generatin
g
w
o
rks
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilar
d
Pall
a
d
d
ed FindGit
.
cmake
s
cript
commit
|
commitdiff
|
tree
2010-03-28
S
z
ila
r
d Pall
fix for gm
x
Gene
r
ateVersionI
n
fo
.
cmake,
now
works
with
.
.
.
commit
|
commitdiff
|
tree
2010-03-25
Szilard Pall
f
ixe
d
USE_VERS
I
ON_H
Cma
k
e option
commit
|
commitdiff
|
tree
2010-03-18
Szilard Pall
Merge
branch
'master' of
g
it@git
.
gromac
s
.
o
rg:gromacs
commit
|
commitdiff
|
tree
2010-03-18
Szilard Pall
fixed
t
he problem
of version
.
c not being built at the
.
.
.
commit
|
commitdiff
|
tree
2010-03-18
Szila
r
d
P
all
added
m
i
s
s
ing VERSION prefix to _g
m
x_
v
er_str
i
ng
commit
|
commitdiff
|
tree
2010-03-16
Szilard
Pall
fix for genve
r
sion
.
sh to recognize the git://
.
.
.
/g
r
o
m
acs
.
.
.
commit
|
commitdiff
|
tree
2010-03-16
Szilard Pall
Merg
e
b
r
a
n
ch 'master' of
g
it@git
.
g
ro
m
acs
.
org:grom
a
cs
commit
|
commitdiff
|
tree
2010-03-16
S
z
i
lard Pal
l
C
m
ake
implementation to generate developmen
t
b
u
ild
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
S
z
ilard Pall
Op
e
nMM bui
l
d not
dependent on fftw an
y
more
commit
|
commitdiff
|
tree
2010-03-11
Szil
a
rd Pall
f
ix
e
d
mdrun verb
o
sit
y
with OpenMM build
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
fixed a mis
s
ing
c
o
m
ma
a
n
d
a typo in
o
p
e
n
m
m
_
wrapper
commit
|
commitdiff
|
tree
2010-03-11
Szila
r
d Pall
Delete src/kernel/do_md_openmm
_
nopatch
.
h, it's
no
t
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pa
l
l
Minor
c
lea
n
up, some r
e
arrang
a
ments, and
c
om
m
enting
.
commit
|
commitdiff
|
tree
2010-03-11
Szila
r
d Pall
Reverted
st
u
pid change in CMaleLis
t
s
.
txt
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
R
e
n
a
m
ed md_openmm in
t
o openmm_wrap
p
er,
and do_md_ope
n
mm
.
.
.
commit
|
commitdiff
|
tree
2010-01-28
Sz
i
lard
Pall
Fixed
d
eadlock occuring in gmx
_
fata
l
.
c: introduc
e
d
.
.
.
commit
|
commitdiff
|
tree