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minor addition to previus gcc 4.1.x disabling commit
2010-08-03
S
z
il
a
rd Pall
m
inor addi
t
ion to
previus gcc 4
.
1
.
x disabling commit
commit
|
commitdiff
|
tree
2010-08-03
Szilard Pal
l
Remov
e
d g
c
c
4
.
1
.
x check as bu
g
431 turn
e
d o
u
t to
b
e
.
.
.
commit
|
commitdiff
|
tree
2010-06-24
Szilard
P
a
l
l
addi
t
ional fix
t
o
commi
t
c5d62af07d01b8, n
o
w libmd
.
.
.
commit
|
commitdiff
|
tree
2010-06-24
Szilard Pall
M
e
r
g
e branch
'
master'
of git@
g
i
t
.
gr
o
ma
c
s
.
org:gromacs
commit
|
commitdiff
|
tree
2010-06-24
Szilard
P
al
l
cmake support for user-defined binary pre
f
ixes, custom
.
.
.
commit
|
commitdiff
|
tree
2010-06-20
S
zil
a
rd
Pall
Merge branch 'master'
of gi
t
@
g
it
.
g
r
omacs
.
org:grom
a
cs
commit
|
commitdiff
|
tree
2010-06-20
Szil
a
rd Pall
F
ixed
GCC ver
s
ion checking in
c
make
commit
|
commitdiff
|
tree
2010-06-17
Szilard Pall
Mer
g
e branch 'm
a
ste
r
'
of git@git
.
g
romacs
.
o
rg:gromacs
commit
|
commitdiff
|
tree
2010-06-17
Szila
r
d
P
all
fix
e
d
minor
b
ug in openmm_wrapper
.
c
pp
commit
|
commitdiff
|
tree
2010-06-17
Szilard
Pall
Implemented (buggy) gcc 4
.
1
.
x check in cmake
.
commit
|
commitdiff
|
tree
2010-06-10
S
z
ilard
Pall
f
i
x
ed
warnings in
gmx_gpu_u
t
ils
a
n
d openmm_wrapper
commit
|
commitdiff
|
tree
2010-06-10
Szil
a
rd Pall
Merge br
a
nch 'master'
o
f git@g
i
t
.
gromacs
.
org:gr
o
m
a
cs
commit
|
commitdiff
|
tree
2010-06-10
Szilard Pall
fix
e
d
logging o
u
t
p
ut in do_md_openmm
commit
|
commitdiff
|
tree
2010-06-03
S
z
ilard Pall
Me
r
ge branch 'm
a
ster' o
f
git@git
.
gromacs
.
org:g
r
o
m
acs
commit
|
commitdiff
|
tree
2010-06-01
Szilard Pall
Merge branch 'master' of git@git
.
gromacs
.
o
rg:gr
o
m
a
cs
commit
|
commitdiff
|
tree
2010-06-01
Szil
a
rd Pall
f
i
xe
d
OpenMM int
e
ract
i
on type check
commit
|
commitdiff
|
tree
2010-05-31
Szilard
Pall
minor fixes in
d
itribution files
commit
|
commitdiff
|
tree
2010-05-31
Szil
a
rd Pall
M
e
rge bran
c
h
'
master' of git@git
.
gro
m
acs
.
org:gr
o
ma
c
s
commit
|
commitdiff
|
tree
2010-05-31
Szi
l
ard Pall
U
pdated R
E
ADME
a
nd
I
NSTALL fi
l
es, add
e
d REA
D
ME-GPU
.
.
.
commit
|
commitdiff
|
tree
2010-05-31
Szilard Pa
l
l
Fixe
d
t
y
po in
C
M
a
keLi
s
ts for mdrun-gpu
commit
|
commitdiff
|
tree
2010-05-30
Szilard Pa
l
l
O
p
e
nMM:
a
dded combination
r
ule
check, disabl
e
d
restraint
.
.
.
commit
|
commitdiff
|
tree
2010-05-30
S
z
ilard Pall
Fix for M
S
VC l
i
nkin
g
and rele
a
se
-
build OpenMM plug
i
n
.
.
.
commit
|
commitdiff
|
tree
2010-05-26
Szilard
Pall
Fixed some
c
ompi
l
er w
a
ri
n
igs
,
minor
bu
g
s and
d
o
cu
m
e
n
t
ation
.
.
.
commit
|
commitdiff
|
tree
2010-05-19
Sz
i
lard Pall
Me
r
ge branch 'mast
e
r' of git@git
.
gromacs
.
org
:
g
romacs
commit
|
commitdiff
|
tree
2010-05-19
Szilard Pall
fi
x
ed the PME toleran
c
e "adjustment" for
OpenMM
commit
|
commitdiff
|
tree
2010-05-12
S
z
ilard Pall
Merge
branch
'master' of
g
it@git
.
gromacs
.
org:gr
o
macs
commit
|
commitdiff
|
tree
2010-05-12
S
z
ila
r
d Pall
Fix in op
e
nmm_
w
rapper which
make
s
i
t
w
ork with MSVC
.
commit
|
commitdiff
|
tree
2010-05-12
Szila
r
d Pall
fixed signal hand
l
ing in md_openmm
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
Merge b
r
a
n
ch 'master
'
of git@git
.
g
r
omacs
.
org:gro
m
acs
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
minor fi
x
e
s
in do
c
umentation + so
m
e
d
ebug
g
ing cod
e
.
.
.
commit
|
commitdiff
|
tree
2010-05-12
Szil
a
rd Pall
added o
s
-spe
c
ific define
s
f
rom cmake req
u
ired by memtestG80
commit
|
commitdiff
|
tree
2010-05-10
Szilar
d
Pall
MS
V
C
f
i
x
for gmx_parallel_3
d
fft
.
c
commit
|
commitdiff
|
tree
2010-05-10
Sz
i
l
ard Pall
only i
s
sue
o
penmm
c
o
n
s
trints warning if constra
i
n
sta
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szilar
d
Pall
Merge bra
n
ch 'm
a
ster' of gi
t
@git
.
grom
a
c
s
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-07
S
z
ilar
d
Pall
temporary fix for
compilation er
r
or wit
h
G
M
X
_OP
E
N
M
M=O
N
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pall
M
e
rg
e
branch 'master' of gi
t
@git
.
gr
o
macs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-07
Szilard Pa
l
l
Merge branch 'master' of git@g
i
t
.
grom
a
cs
.
org:g
r
omacs
commit
|
commitdiff
|
tree
2010-05-07
Sz
i
l
ard
P
all
added gro
m
acs file headers
t
o t
h
e Op
e
nMM-rel
a
ted f
i
les
commit
|
commitdiff
|
tree
2010-05-07
Szil
a
rd Pall
mino
r
fixes, docum
e
ntation and slight API
chan
g
e in
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szil
a
rd P
a
ll
minor upda
t
es to Find
G
it and
F
in
d
OpenMM
commit
|
commitdiff
|
tree
2010-05-07
Szi
l
ard
P
all
up
d
a
t
ed FindC
U
DA to version from cmak
e
2
.
8
.
1
for
C
UD
A
.
.
.
commit
|
commitdiff
|
tree
2010-04-20
Szi
l
ar
d
P
al
l
Merge branch 'master' of git
@
git
.
gromacs
.
org
:
gro
m
acs
commit
|
commitdiff
|
tree
2010-04-20
Szilar
d
Pall
doxyg
e
n comments for the OpenMM pa
r
t
commit
|
commitdiff
|
tree
2010-04-16
S
z
ilard
P
al
l
added documenta
t
ion for
t
he openmm_wrapper
commit
|
commitdiff
|
tree
2010-04-16
Szilard Pall
formatting fix
o
f
openmm wrapper - gromacsifie
d
the
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pall
cleaned u
p
a
b
unch op
m
e
s
s in
d
o_md_openmm
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pall
bugfix
f
or
do_md_openmm
- was al
w
ays
p
ulling data from
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szil
a
rd Pall
fixed timing bug
in do_md_openmm
commit
|
commitdiff
|
tree
2010-04-13
Szi
l
ar
d
Pall
adde
d
some more sup
p
o
r
ted GPUs (high
-
end mo
b
ile
and
.
.
.
commit
|
commitdiff
|
tree
2010-04-06
Szilard
P
all
M
e
rge branch 'mast
e
r
' of git@git
.
g
roma
c
s
.
org:gromacs
commit
|
commitdiff
|
tree
2010-04-06
Szilard Pal
l
now g_ba
r
lo
o
ks f
o
r lambd
a
only in the l
a
st dir
e
ct
o
ry
.
.
.
commit
|
commitdiff
|
tree
2010-04-04
Szilard
P
al
l
Fix
e
d g_ba
r
bug in lambda value parsing from path
.
commit
|
commitdiff
|
tree
2010-03-29
Szilard Pall
fixed gmxGenerate
V
ersi
o
nI
n
fo
.
cmake to
prod
u
ce 8
digit
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szi
l
ard Pall
The cm
a
ke develo
p
m
e
nt information genera
t
i
ng wo
r
ks
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
added FindGi
t
.
cm
a
k
e
script
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pa
l
l
f
i
x for
g
m
xGenerateVersionInfo
.
cmake, now works with
.
.
.
commit
|
commitdiff
|
tree
2010-03-25
Sz
i
lard Pall
f
i
x
e
d
USE_VERSION_H Cmake
o
ption
commit
|
commitdiff
|
tree
2010-03-18
Szil
a
rd P
a
ll
Merge branch
'master'
o
f
gi
t
@git
.
gr
o
macs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-03-18
Szi
l
ard Pall
fixed the pr
o
b
l
em of version
.
c
not being built at the
.
.
.
commit
|
commitdiff
|
tree
2010-03-18
S
zilard
Pall
add
e
d
m
i
s
si
n
g VERSION pre
f
ix to _gmx_ver_string
commit
|
commitdiff
|
tree
2010-03-16
Szi
l
ard Pall
fix for genvers
i
o
n
.
sh to recognize th
e
git://
.
.
.
/
gr
o
macs
.
.
.
commit
|
commitdiff
|
tree
2010-03-16
Szilard Pall
Merge branch
'master' of git@git
.
g
ro
m
acs
.
org:groma
c
s
commit
|
commitdiff
|
tree
2010-03-16
Szilar
d
Pall
C
make
i
mplemen
t
ation
t
o
ge
n
erate d
e
velopment build
.
.
.
commit
|
commitdiff
|
tree
2010-01-28
Szilard Pall
F
i
x
e
d deadlock occur
i
ng in
g
m
x
_fatal
.
c:
i
n
t
roduced
.
.
.
commit
|
commitdiff
|
tree