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Improved option disabling on switching to OpenMM build in a non-clean build tree
2010-08-31
S
z
i
l
ard Pall
I
mproved option disabling
on
s
witching to Op
e
n
M
M
b
u
ild
.
.
.
commit
|
commitdiff
|
tree
2010-08-31
Szil
a
rd Pall
f
ixe
d
/
i
mp
r
o
v
ed cmake F
F
TW3 detection
commit
|
commitdiff
|
tree
2010-08-03
Szilard Pall
minor addition to previus gcc
4
.
1
.
x d
i
sab
l
ing commit
commit
|
commitdiff
|
tree
2010-08-03
Szila
r
d Pall
Removed gcc 4
.
1
.
x ch
e
ck
a
s bug 4
3
1
t
urned
out
t
o be
.
.
.
commit
|
commitdiff
|
tree
2010-06-24
S
zilard Pall
addit
i
onal fix to
c
ommit c5
d
62af07d01b8,
n
o
w libmd
.
.
.
commit
|
commitdiff
|
tree
2010-06-24
S
z
i
lard Pa
l
l
Merge branch 'master' of git@git
.
g
r
omacs
.
org:grom
a
cs
commit
|
commitdiff
|
tree
2010-06-24
Szil
a
rd Pall
cmake s
u
p
port for u
s
er-de
f
ine
d
binary prefixes, custom
.
.
.
commit
|
commitdiff
|
tree
2010-06-20
Szilard Pall
Merge bra
n
ch
'
m
aster' of git@
g
it
.
gromacs
.
o
r
g:groma
c
s
commit
|
commitdiff
|
tree
2010-06-20
Szilard Pal
l
Fixed GCC versio
n
chec
k
ing in c
m
ake
commit
|
commitdiff
|
tree
2010-06-17
Szi
l
a
rd P
a
ll
M
erge branch 'mas
t
er' of git@git
.
g
romacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-06-17
S
z
i
la
r
d Pall
fixed
minor bu
g
in openmm_wrapper
.
cpp
commit
|
commitdiff
|
tree
2010-06-17
Szil
a
rd Pall
I
m
plemented (bu
g
g
y) g
c
c 4
.
1
.
x check in cmake
.
commit
|
commitdiff
|
tree
2010-06-10
Sz
i
lard Pall
fixed war
n
ings in
g
mx_gpu_ut
i
ls and
o
p
en
m
m_wrapper
commit
|
commitdiff
|
tree
2010-06-10
Szilard Pall
Merge
b
ranch 'mast
e
r' of git@git
.
groma
c
s
.
org:
g
romacs
commit
|
commitdiff
|
tree
2010-06-10
Szila
r
d Pall
fi
x
e
d
loggi
n
g output in do_
m
d_op
e
n
m
m
commit
|
commitdiff
|
tree
2010-06-03
S
z
ilard Pall
M
erge branch 'master' of git@git
.
gr
o
macs
.
o
r
g:gromacs
commit
|
commitdiff
|
tree
2010-06-01
S
z
i
lar
d
P
all
Merge branc
h
'maste
r
' of git
@
g
i
t
.
g
r
omacs
.
org:
g
r
o
macs
commit
|
commitdiff
|
tree
2010-06-01
S
zi
l
ard P
a
ll
fixed OpenMM
interacti
o
n t
y
pe
c
heck
commit
|
commitdiff
|
tree
2010-05-31
S
z
ilard Pall
minor fixes in ditributi
o
n files
commit
|
commitdiff
|
tree
2010-05-31
Szilard P
a
l
l
Mer
g
e branch '
m
aster' of g
i
t@git
.
gromac
s
.
org:gro
m
acs
commit
|
commitdiff
|
tree
2010-05-31
Szi
l
ard Pall
Updated README and INSTALL files, added
R
EAD
M
E-GPU
.
.
.
commit
|
commitdiff
|
tree
2010-05-31
Szilard Pall
Fixed typo in CMakeLis
t
s for
m
d
run-gpu
commit
|
commitdiff
|
tree
2010-05-30
Szila
r
d Pall
OpenMM: ad
d
ed c
o
m
b
i
n
at
i
o
n rule check
,
d
i
s
able
d
restr
a
int
.
.
.
commit
|
commitdiff
|
tree
2010-05-30
Szilard Pall
Fix for
M
SVC linkin
g
a
nd relea
s
e-build Open
M
M plugin
.
.
.
commit
|
commitdiff
|
tree
2010-05-26
Szil
a
rd Pall
Fixe
d
some c
o
mpiler warinigs, minor bu
g
s an
d
do
c
umenta
t
i
on
.
.
.
commit
|
commitdiff
|
tree
2010-05-19
Szilard Pa
l
l
Me
r
ge br
a
nch 'm
a
ster' of git@git
.
gromacs
.
or
g
:gromac
s
commit
|
commitdiff
|
tree
2010-05-19
Szilard Pall
f
i
xed t
h
e P
M
E t
o
lerance
"
adjus
t
ment" for O
p
e
nMM
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
Mer
g
e branch 'mas
t
er
'
of g
i
t@gi
t
.
gromacs
.
org
:
gro
m
acs
commit
|
commitdiff
|
tree
2010-05-12
Szila
r
d Pall
F
i
x in openm
m
_wrappe
r
which
mak
e
s it work
w
ith MSVC
.
commit
|
commitdiff
|
tree
2010-05-12
Szilard P
a
ll
f
ixe
d
signal handling in md_o
p
en
m
m
commit
|
commitdiff
|
tree
2010-05-12
S
z
ilard
P
all
Me
r
ge branch 'ma
s
ter' of git@git
.
gromacs
.
org:gromac
s
commit
|
commitdiff
|
tree
2010-05-12
S
zila
r
d
Pall
mi
n
or
fixes in
documentation + some
d
ebugging
code
.
.
.
commit
|
commitdiff
|
tree
2010-05-12
S
zilard Pall
added o
s
-s
p
ecific
d
e
f
ines fro
m
cmake required by
m
emtestG8
0
commit
|
commitdiff
|
tree
2010-05-10
Sz
i
lard
P
a
l
l
MS
V
C
f
i
x for gmx_parallel_3dfft
.
c
commit
|
commitdiff
|
tree
2010-05-10
Szilard Pall
only iss
u
e
openmm constrints
w
arning if constra
i
nsta
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pall
Merge branch 'master' of git@git
.
gromacs
.
org
:
gromacs
commit
|
commitdiff
|
tree
2010-05-07
S
z
i
lard
P
al
l
tem
p
orar
y
f
i
x for compilati
o
n error w
i
th
G
MX
_
OPENMM=ON
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pa
l
l
Me
r
ge branch 'm
a
ster' o
f
git@git
.
gromacs
.
org:g
r
o
m
acs
commit
|
commitdiff
|
tree
2010-05-07
Szilard P
a
ll
Merge branch
'
m
aster' of
git@git
.
gromacs
.
or
g
:gr
o
macs
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pall
added g
r
omacs file
h
eaders to
t
he Op
e
nMM-related files
commit
|
commitdiff
|
tree
2010-05-07
Szilard
P
all
m
ino
r
fixes, documentation and slight API change in
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
S
zilard Pall
m
inor
u
pda
t
es t
o
FindGit and FindOpenMM
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pal
l
upd
a
ted FindC
U
DA
t
o version from
c
m
ake 2
.
8
.
1 for CUDA
.
.
.
commit
|
commitdiff
|
tree
2010-04-20
Szilard Pa
l
l
Merge branch 'master
'
of
g
it@git
.
g
r
omacs
.
org:
g
romacs
commit
|
commitdiff
|
tree
2010-04-20
Szilar
d
Pall
d
oxyge
n
comments for the OpenMM part
commit
|
commitdiff
|
tree
2010-04-16
Szilard Pa
l
l
added
d
ocumenta
t
i
o
n f
o
r the openmm_wrapper
commit
|
commitdiff
|
tree
2010-04-16
S
zi
l
ard Pall
formatt
i
ng fix
o
f openmm wrappe
r
-
g
r
o
m
acsifi
e
d the
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pall
c
leaned u
p
a bunch op
mess in do_md_open
m
m
commit
|
commitdiff
|
tree
2010-04-13
S
zilar
d
Pall
bugfix for d
o
_md_openmm - was always pullin
g
da
t
a fr
o
m
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szila
r
d Pall
fixed tim
i
ng bug in do_md_open
m
m
commit
|
commitdiff
|
tree
2010-04-13
Szila
r
d Pall
adde
d
some more sup
p
o
r
ted GPUs (h
i
g
h
-
end mobile an
d
.
.
.
commit
|
commitdiff
|
tree
2010-04-06
Sz
i
l
a
rd Pall
Merge branch 'master'
of git@git
.
gromacs
.
org:gro
m
a
cs
commit
|
commitdiff
|
tree
2010-04-06
Szila
r
d
P
a
l
l
now g_ba
r
looks for lambda only in the last directory
.
.
.
commit
|
commitdiff
|
tree
2010-04-04
Szila
r
d Pall
Fixed g_
b
ar bug in lambda
v
alu
e
parsi
n
g f
r
om path
.
commit
|
commitdiff
|
tree
2010-03-29
Szilard Pall
f
ixed
gmxGenerateVersionInfo
.
cmake to produce
8 digit
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szil
a
r
d Pa
l
l
The cmak
e
de
v
elopment inform
a
tion ge
n
e
r
ating
works
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pa
l
l
adde
d
FindGit
.
cmake script
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
fix for gmx
G
en
e
rateVersion
I
nfo
.
cmake, no
w
w
o
r
ks
with
.
.
.
commit
|
commitdiff
|
tree
2010-03-25
Sz
i
lar
d
Pall
fixed U
S
E_VERSION_H Cmak
e
o
p
tio
n
commit
|
commitdiff
|
tree
2010-03-18
Szila
r
d Pall
Merge branch
'm
a
ster' of git@git
.
g
romacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-03-18
S
z
i
l
a
r
d Pa
l
l
f
ixed the prob
l
em of ve
r
sio
n
.
c not being built
a
t the
.
.
.
commit
|
commitdiff
|
tree
2010-03-18
Sz
i
la
r
d P
a
ll
added
m
i
ssing VERSION p
r
e
fix to _gmx_
v
er_s
t
ring
commit
|
commitdiff
|
tree
2010-03-16
Szilard Pall
fix for g
e
n
version
.
sh to recogniz
e
the git:/
/
.
.
.
/g
r
o
m
a
c
s
.
.
.
commit
|
commitdiff
|
tree
2010-03-16
Sz
i
l
a
rd Pall
Me
r
ge branch '
m
ast
e
r'
of
git@git
.
g
r
o
m
a
cs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-03-16
S
zilard Pall
Cmake implement
a
tion to gen
e
rate development bui
l
d
.
.
.
commit
|
commitdiff
|
tree
2010-01-28
Szilard Pall
Fixed deadlock occuring
i
n
g
m
x_fatal
.
c: introduce
d
.
.
.
commit
|
commitdiff
|
tree