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Fix usage of gmx_eof
2014-04-30
Rolan
d
S
c
hulz
Fix us
a
ge of gmx
_
eof
commit
|
commitdiff
|
tree
2014-04-16
Roland Schulz
Fi
x
w
hitespace
commit
|
commitdiff
|
tree
2014-04-14
Roland
Schu
l
z
Improve la
n
guage choice
commit
|
commitdiff
|
tree
2014-04-10
Mark
A
b
raham
Further fix to g
m
x
tune-pme
commit
|
commitdiff
|
tree
2014-03-11
Rola
n
d S
c
hulz
Don't
d
i
s
abl
e
MSVC warnings
i
n confi
g
.
h
commit
|
commitdiff
|
tree
2014-03-05
Roland Schulz
Add Re
l
With
A
ss
e
rt build type
commit
|
commitdiff
|
tree
2014-03-03
Roland Schul
z
Merge release-4-6
i
n
to mas
t
er
commit
|
commitdiff
|
tree
2014-02-28
Teemu Murtola
Convert gmx
-
s
as to the
C
+
+
fram
e
work
commit
|
commitdiff
|
tree
2014-02-28
T
eemu
Mu
r
tola
Add suppor
t
for
n
on-unifor
m
X axi
s
in
a
rray data
commit
|
commitdiff
|
tree
2014-02-26
Ro
l
and Sc
h
u
lz
Remove Cygwin+MingW from i
n
stallguide
commit
|
commitdiff
|
tree
2014-02-24
Mark Ab
r
aham
Cle
a
n
u
p
options
f
or
d
omain decomposition
commit
|
commitdiff
|
tree
2014-02-21
Roland
S
c
h
u
lz
Mer
g
e release-4-6 into master
commit
|
commitdiff
|
tree
2014-02-21
M
a
rk Abraham
Reinsta
t
e s
h
ell code with
D
D
commit
|
commitdiff
|
tree
2014-02-12
Mark Abraham
Refactored
'solvate'
and 'insert-molecules'
commit
|
commitdiff
|
tree
2014-02-02
R
o
land Schulz
Me
r
ge release-4-6 into master
commit
|
commitdiff
|
tree
2014-01-30
Teemu M
u
rtola
O
verview docs for
w
rap
p
er binar
y
implementat
i
o
n
commit
|
commitdiff
|
tree
2014-01-21
Mar
k
Abraham
M
o
ve
more prep
r
ocessing files into the mo
d
ule
commit
|
commitdiff
|
tree
2014-01-15
Teemu Murtola
Uni
t
tests for parse_c
o
mmon_
a
r
gs
(
)
commit
|
commitdiff
|
tree
2014-01-09
Ro
l
and
Sc
h
ulz
M
e
rge relea
s
e-4-6 into m
a
s
t
er
commit
|
commitdiff
|
tree
2014-01-01
Roland Schulz
Me
r
ge release-4-6 into
master
commit
|
commitdiff
|
tree
2013-11-12
Rolan
d
Schul
z
Added rotation to the tes
t
s run by ctes
t
commit
|
commitdiff
|
tree
2013-10-30
Roland
S
c
hulz
Fix bu
i
l
d with G
M
X_
C
YCLE_SUB
C
O
U
N
TERS
commit
|
commitdiff
|
tree
2013-10-30
Roland S
c
hu
l
z
Merge release-
4
-6 into ma
s
ter
commit
|
commitdiff
|
tree
2013-06-27
Roland S
c
hulz
M
e
rge branc
h
'
r
e
l
ease-4-6
'
int
o
m
aster
commit
|
commitdiff
|
tree
2013-05-21
Rol
a
nd Schulz
Merge release-4-6 into m
a
ste
r
commit
|
commitdiff
|
tree
2013-03-26
Roland Schulz
M
erge release
-
4-
5
-pa
t
c
h
es into re
l
ease
-
4-6
commit
|
commitdiff
|
tree
2013-03-20
Roland Schulz
M
er
g
e
r
ele
a
se-4-6
into master
commit
|
commitdiff
|
tree
2013-02-26
Roland Schulz
Merge release-4-6 into master
commit
|
commitdiff
|
tree
2013-02-13
Rol
a
nd Schulz
M
e
rge rele
a
se-4-6
into master
commit
|
commitdiff
|
tree
2013-02-13
Roland Schulz
Merge rele
a
s
e
-
4-6 into ma
s
t
e
r
commit
|
commitdiff
|
tree
2013-02-13
R
o
l
a
n
d
S
chulz
Code beau
t
if
i
c
ation with uncrustify
commit
|
commitdiff
|
tree
2013-02-08
Roland Schu
l
z
Fix CUDA_HOST_COMPILER flag
name
commit
|
commitdiff
|
tree
2013-02-08
Roland Schu
l
z
Re
m
o
ve duplicated c
l
a
ng
s
e
c
t
ion
commit
|
commitdiff
|
tree
2013-02-08
Roland Schu
l
z
R
emov
e
dum
m
y
.
cp
p
commit
|
commitdiff
|
tree
2013-01-30
Roland S
c
hulz
Fix gm
x
c
h
eck
target
commit
|
commitdiff
|
tree
2013-01-21
Roland S
c
hulz
M
e
rge release-4-6 into maste
r
commit
|
commitdiff
|
tree
2013-01-20
Roland Sch
u
lz
Merge release-4-6 into master
commit
|
commitdiff
|
tree
2013-01-19
Roland Schulz
Add fftpack
t
o
E
XTRA_DIST
commit
|
commitdiff
|
tree
2013-01-19
R
oland S
c
hulz
Rel
e
ase
4
.
5
.
6
commit
|
commitdiff
|
tree
2013-01-18
R
o
l
a
nd Sc
h
ulz
Merge release-4-
5
-pa
t
ches
into releas
e
-4-6
commit
|
commitdiff
|
tree
2013-01-18
Roland Schulz
Fix rea
d
ing of g9
6
titl
e
commit
|
commitdiff
|
tree
2013-01-15
Roland Schul
z
M
erge release-
4
-6 into m
a
ster
commit
|
commitdiff
|
tree
2013-01-15
Roland Sc
h
ulz
Fi
x
missing replacement/typo
commit
|
commitdiff
|
tree
2013-01-11
Roland Schulz
M
erge relea
s
e-4-5-patches into rel
e
a
se
-
4-
6
commit
|
commitdiff
|
tree
2013-01-11
R
o
land Schulz
A
dd
e
d missing export
commit
|
commitdiff
|
tree
2013-01-11
David van der Spoel
Fixes #994 c
o
nfusion
i
n atompro
p
.
commit
|
commitdiff
|
tree
2013-01-10
Rol
a
nd
Schulz
Remove incorrect assert added
b
y 05f9
a
740
commit
|
commitdiff
|
tree
2013-01-07
Roland
S
c
hulz
Fix
CUDA
b
eing quiet
a
nd mark a
l
l CUDA_* as advanced
commit
|
commitdiff
|
tree
2012-12-21
Rola
n
d
S
chulz
Ign
o
re bool ca
s
t warning
for
M
SVC
a
nd C+
+
commit
|
commitdiff
|
tree
2012-12-20
Roland Schu
l
z
M
erge rel
e
ase-4-6 int
o
mas
t
er
commit
|
commitdiff
|
tree
2012-12-12
Roland Schulz
M
e
rge release-4-6 into master
commit
|
commitdiff
|
tree
2012-12-10
T
e
emu
M
u
rtola
Ren
a
m
e
g_ana to gmx
.
commit
|
commitdiff
|
tree
2012-12-08
Rola
n
d
S
chulz
Fix compilation wit
h
PGI
commit
|
commitdiff
|
tree
2012-12-05
Rol
a
nd Schul
z
Remov
e
TEST_
T
MP
I
_ATOMICS_ON
L
Y
commit
|
commitdiff
|
tree
2012-12-03
Rolan
d
Schulz
Merge release-4-6 i
n
t
o
master
commit
|
commitdiff
|
tree
2012-11-30
Szil
a
rd Pall
force C++ lin
k
i
n
g of
t
h
e gpu_u
t
ils
commit
|
commitdiff
|
tree
2012-11-28
Ro
l
and
Schul
z
Fi
x
:
pth
r
ead variables were overwritten by gmxManag
e
GPU
commit
|
commitdiff
|
tree
2012-11-28
Rolan
d
Schulz
Fix CPACK_SOURCE_IG
N
ORE_FILES
commit
|
commitdiff
|
tree
2012-11-28
Roland Schulz
Pri
n
t error
if no thr
e
ad s
u
ppo
r
t is available
commit
|
commitdiff
|
tree
2012-11-27
Roland Schulz
Fix Window-GPU build
commit
|
commitdiff
|
tree
2012-11-27
Roland Schulz
Rem
o
ve CVS files
commit
|
commitdiff
|
tree
2012-11-27
Er
i
k Lindahl
Nonbonded gr
o
u
p kernels for 25
6
-
b
it AVX
(
Intel CPUs)
commit
|
commitdiff
|
tree
2012-11-27
Sander Pro
n
k
Added affinity support check, visibility macros in
.
.
.
commit
|
commitdiff
|
tree
2012-11-26
Roland Sch
u
lz
Merge r
e
l
ea
s
e
-4-5-p
a
tc
h
es into
relea
s
e
-4-6
commit
|
commitdiff
|
tree
2012-11-26
Roland S
c
hulz
Add mis
s
ing
l
inker flags
commit
|
commitdiff
|
tree
2012-11-25
R
o
land Schul
z
M
e
rge
release-4-6
into master
commit
|
commitdiff
|
tree
2012-11-24
Roland Schulz
Use stat for gmx_is_file
.
F
i
x get_libdir with
s
y
ml
i
nks
.
commit
|
commitdiff
|
tree
2012-11-22
R
o
land
Schulz
Fix li
n
ker path for
M
acOS
commit
|
commitdiff
|
tree
2012-11-20
R
oland Schulz
F
i
x
CX
X
/C mismatch
o
f
f
lag/ma
c
ro for gmxCFlags
commit
|
commitdiff
|
tree
2012-11-20
Ro
l
and Schulz
Merge
release-4
-
5-patc
h
es into
r
el
e
ase-4-6
commit
|
commitdiff
|
tree
2012-11-20
Rol
a
nd Schulz
Fix CXX/C mism
a
tch
o
f
f
l
ag/macro for gmxCF
l
ags
commit
|
commitdiff
|
tree
2012-11-19
Roland Schulz
Merge 'release
-
4-6' in
t
o
master
commit
|
commitdiff
|
tree
2012-11-16
R
oland
Schu
l
z
Removing Zn an
d
Ar
n
on-OPLS
a
tom
t
y
pes
commit
|
commitdiff
|
tree
2012-11-16
Roland S
c
hulz
Rem
o
ves unused files
commit
|
commitdiff
|
tree
2012-11-14
Ro
l
a
n
d
S
chulz
FindFFTW:
K
eep checkin
g
pkg_
c
onfig unti
l
fftw is found
commit
|
commitdiff
|
tree
2012-11-12
Rola
n
d Schulz
M
e
rge
r
elease-
4
-6 into
m
a
s
te
r
commit
|
commitdiff
|
tree
2012-11-12
Rol
a
n
d Schulz
Test that compiling and link
i
ng o
f
AV
X
w
o
r
ks
commit
|
commitdiff
|
tree
2012-11-11
Roland Schu
l
z
F
i
x FMA4 compile for G
C
C an
d
MSVC
commit
|
commitdiff
|
tree
2012-11-10
Rolan
d
Schulz
Merge r
e
lease-4
-
6 into master
commit
|
commitdiff
|
tree
2012-11-10
Roland
S
chulz
Fix g_
m
sd -mo
l
commit
|
commitdiff
|
tree
2012-11-09
R
oland Schulz
Mer
g
e
o
r
i
gin/relea
s
e-4-6
into master
commit
|
commitdiff
|
tree
2012-11-09
Roland Schulz
F
ix
c
omponent for libcudart
commit
|
commitdiff
|
tree
2012-11-05
R
o
l
and
S
ch
u
lz
Add o
p
tion to
instal
l
l
i
b
cudart
commit
|
commitdiff
|
tree
2012-11-03
R
o
lan
d
Sch
u
lz
M
erge relea
s
e-4-6 into
master
commit
|
commitdiff
|
tree
2012-11-03
Rol
a
nd Schulz
Merge release-4-
5
-pa
t
ches into r
e
lease-4-6
commit
|
commitdiff
|
tree
2012-10-27
R
oland Schulz
Set H
A
VE_FSEEKO
c
onsistently in o
n
e place
commit
|
commitdiff
|
tree
2012-10-25
Roland
S
c
hulz
Me
r
ge
remote-tracking
branch
'or
i
gin
/
rele
a
se-4-6' into
.
.
.
commit
|
commitdiff
|
tree
2012-10-23
Roland S
c
hulz
Replace sprin
t
f
with snprintf to make saf
e
commit
|
commitdiff
|
tree
2012-10-19
Roland
Sch
u
lz
Fix lar
g
e file sup
p
o
rt
commit
|
commitdiff
|
tree
2012-10-19
Ro
l
an
d
Schulz
Mer
g
e
branch 'release-4-6'
commit
|
commitdiff
|
tree
2012-10-17
Roland Schulz
Fixed Pulp Fi
c
ti
o
n quote
commit
|
commitdiff
|
tree
2012-10-17
Roland Schu
l
z
Merge
branch
'relea
s
e-4-6'
commit
|
commitdiff
|
tree
2012-10-17
Roland
Schulz
Merge b
r
a
n
ch
'
release-4-6', adds the nbnxn
functional
i
ty
commit
|
commitdiff
|
tree
2012-10-12
R
o
land Schul
z
Fix illegal barrier in worksharin
g
commit
|
commitdiff
|
tree
2012-10-10
Rola
n
d
S
chulz
Make Gromacs compile without C
+
+ compiler
commit
|
commitdiff
|
tree
2012-10-06
Ro
l
and Sch
u
lz
Fix incorrect free
commit
|
commitdiff
|
tree
2012-10-06
Roland Schulz
Fix compile
r
warnings
commit
|
commitdiff
|
tree
2012-10-04
Roland Schulz
Merg
e
re
l
ease-4-6
i
nto master
commit
|
commitdiff
|
tree
2012-10-01
Roland Schulz
Merge releas
e
-4-6 int
o
master
commit
|
commitdiff
|
tree
2012-10-01
Roland Schulz
Merge
release-4-5
-
p
a
tches
into r
e
l
ease-4-6
commit
|
commitdiff
|
tree
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