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Remove commrec from set_ddbox()
2016-03-11
Roland Schu
l
z
Fi
x
MPI_
I
N
_
PL
A
CE
t
est
commit
|
commitdiff
|
tree
2016-03-10
R
o
l
a
nd
S
chulz
Improve AV
X
512
commit
|
commitdiff
|
tree
2015-12-27
Rola
n
d Schul
z
Fix
G
++ 4
.
7
.
0
commit
|
commitdiff
|
tree
2015-12-08
Rol
a
nd
S
chulz
Remove old MSVC references
commit
|
commitdiff
|
tree
2015-09-30
Roland S
c
hu
l
z
R
e
quire C++11
commit
|
commitdiff
|
tree
2015-09-30
R
o
la
n
d Schulz
Manual
l
y pr
o
pa
g
a
t
e
CUD
A
host compiler flags
commit
|
commitdiff
|
tree
2015-09-27
Roland Schulz
C
onvert
e
d 4
x
n kernel to C++
commit
|
commitdiff
|
tree
2015-09-23
Ro
l
and Sch
u
lz
Bump require
d
C
U
DA v
e
r
s
ion
f
rom 4
.
0+ to 5
.
0+
commit
|
commitdiff
|
tree
2015-08-15
R
o
l
a
n
d Schulz
Fix Cla
n
g warn
i
n
g
commit
|
commitdiff
|
tree
2015-08-07
Rol
a
nd Schulz
Fix VS2015
w
arnin
g
commit
|
commitdiff
|
tree
2015-08-07
Roland Schulz
Fix missin
g
inclu
d
e
commit
|
commitdiff
|
tree
2015-08-06
Roland S
c
h
ulz
Replace AI, AJ,
.
.
and C0, C1, C2
m
a
cros with
f
u
nctions
commit
|
commitdiff
|
tree
2015-07-28
Roland
S
chulz
Co
n
verted 2x
n
n ke
r
nel to C++
commit
|
commitdiff
|
tree
2015-07-11
Rol
a
nd
S
chulz
Update kernel te
m
plates to ma
t
ch kernels
commit
|
commitdiff
|
tree
2015-07-09
Roland S
c
h
u
lz
New quotes
commit
|
commitdiff
|
tree
2015-07-08
Roland
S
chulz
M
erge release-5-
1
in
t
o mas
t
er
commit
|
commitdiff
|
tree
2015-07-08
Ro
l
and
S
chulz
M
e
rg
e
relea
s
e-5-0
i
nto rel
e
ase-5-
1
commit
|
commitdiff
|
tree
2015-07-08
Rolan
d
Sch
u
lz
Merge
release-4-6
i
nto release-5-0
commit
|
commitdiff
|
tree
2015-06-28
R
o
land Schulz
Remove unused cmake
files
commit
|
commitdiff
|
tree
2015-06-28
R
o
l
a
nd Schu
l
z
Don
'
t use
check_library for li
b
m
commit
|
commitdiff
|
tree
2015-06-25
Roland Schulz
Fix Wund
e
f warnings
commit
|
commitdiff
|
tree
2015-06-22
Roland Sc
h
ulz
Fix GMX_ALIGNMENT for MSVC
2012
a
nd 2013
commit
|
commitdiff
|
tree
2015-06-22
R
olan
d
S
chulz
Fix
c
make
3
.
1 warnings with MSVC
commit
|
commitdiff
|
tree
2015-06-19
Rolan
d
Sch
u
lz
Fix missing include
commit
|
commitdiff
|
tree
2015-06-16
Roland Schu
l
z
F
i
x warning in uncru
s
tify
commit
|
commitdiff
|
tree
2015-06-16
Roland Schulz
Fix consts in bonded and clincs
commit
|
commitdiff
|
tree
2015-06-06
Ro
l
an
d
Schul
z
U
s
e st
a
t to check that path
s
are e
q
uivalent
commit
|
commitdiff
|
tree
2015-06-05
Rol
a
n
d
Schulz
Mer
g
e release-5-
0
i
n
to master
commit
|
commitdiff
|
tree
2015-06-05
R
o
lan
d
Schu
l
z
Re
e
nab
l
e lincs/bonded SIMD for I
C
C on Wind
o
w
s
commit
|
commitdiff
|
tree
2015-06-03
Roland Schulz
Use stack buff
e
r for LINCS&bond
e
d ga
t
h
e
r/sc
a
tter
commit
|
commitdiff
|
tree
2015-05-30
Roland
S
chulz
Work-ar
o
und for ICC 15 on
P
hi
commit
|
commitdiff
|
tree
2015-05-26
R
o
lan
d
Schulz
Don
'
t set CFLAG
S
for Phi in toolchain
commit
|
commitdiff
|
tree
2015-05-13
Roland Sch
u
lz
Facilit
a
te
l
inkin
g
o
f static bin
a
ries
commit
|
commitdiff
|
tree
2015-03-17
Roland
S
chulz
Fi
x
l
i
n
k
i
ng with s
t
a
t
ic li
b
xm
l
2
commit
|
commitdiff
|
tree
2015-03-04
Roland Schul
z
Fix GCC5 wa
r
nings
commit
|
commitdiff
|
tree
2015-03-03
Ro
l
and Schulz
nbnxn u
t
ils
p
e
rfo
r
mance
i
mprovement for Phi
commit
|
commitdiff
|
tree
2015-03-02
Roland Schulz
Don't search installat
i
on prefi
x
if binary is not found
commit
|
commitdiff
|
tree
2015-02-25
Roland Schulz
C++ conversion for PME
s
p
r
ead/gather
commit
|
commitdiff
|
tree
2015-02-12
Roland Schulz
Me
r
ge
r
elease-5-0 into master
commit
|
commitdiff
|
tree
2015-02-12
Rol
a
n
d
S
chulz
Merge rel
e
ase-4-6 into release
-
5-0
commit
|
commitdiff
|
tree
2015-02-10
Roland Schul
z
Do
n
't set CFLAG
S
for Phi in
to
o
l
c
h
ain
commit
|
commitdiff
|
tree
2015-02-10
Ro
l
a
n
d S
c
hulz
Wor
k
-around
for ICC 15 on
Phi
commit
|
commitdiff
|
tree
2015-02-07
Ro
l
and Schulz
Make
F
indBoost quite
commit
|
commitdiff
|
tree
2015-02-02
R
oland Sch
u
lz
Fix FP ex
c
e
ption i
n
FE
commit
|
commitdiff
|
tree
2015-01-27
R
o
land
S
chulz
Work
a
round for Mem
o
rySanitizer
commit
|
commitdiff
|
tree
2015-01-27
Roland Schulz
Fix unitlized m
e
mor
y
read in checkpoi
n
t
commit
|
commitdiff
|
tree
2015-01-05
Ro
l
and Sc
h
ulz
En
a
ble fp-e
x
ceptions
commit
|
commitdiff
|
tree
2014-12-18
Roland Sch
u
lz
F
ix CMP00
5
4
cmak
e
3
.
1
.
0
warnings
commit
|
commitdiff
|
tree
2014-12-17
Ro
l
an
d
Schulz
Merge "
M
erg
e
bra
n
ch '
r
e
lease-5-0
'
"
commit
|
commitdiff
|
tree
2014-12-17
Rolan
d
Schulz
Fix cppcheck
-
1
.
6
7 warnings
commit
|
commitdiff
|
tree
2014-12-15
Ro
l
a
n
d S
c
hulz
Fix NVML detection on Wind
o
ws
commit
|
commitdiff
|
tree
2014-12-13
Roland Schulz
Us
e
bitma
s
k
for bonde
d
commit
|
commitdiff
|
tree
2014-12-07
R
o
land Schulz
Merge release-5-0 into master
commit
|
commitdiff
|
tree
2014-11-26
Roland Schulz
Fix clang with b
o
o
st 1
.
46
.
1 and 1
.
47
commit
|
commitdiff
|
tree
2014-11-26
Roland Schulz
Me
r
ge relea
s
e-5-0
i
nto master
commit
|
commitdiff
|
tree
2014-11-23
Roland
S
c
hu
l
z
Se
t
GMX_SIMD to MIC for Xeo
n
Phi
commit
|
commitdiff
|
tree
2014-11-12
Rol
a
nd Schul
z
Use stat t
o
check that paths a
r
e equiva
l
ent
commit
|
commitdiff
|
tree
2014-11-12
Roland Schulz
Add
b
it
m
ask type
commit
|
commitdiff
|
tree
2014-11-09
Roland Schul
z
Back
p
ort valgri
n
d suppre
s
sion
commit
|
commitdiff
|
tree
2014-11-09
Roland Schulz
F
i
x CMP0054 cmake 3
.
1
.
0 warnings
commit
|
commitdiff
|
tree
2014-11-05
Rolan
d
Schulz
Minor
u
p
date of boost RE
A
DME
commit
|
commitdiff
|
tree
2014-10-30
Ro
l
and
S
chulz
Merge "M
e
rge re
l
e
a
s
e
-5
-
0
i
nto master"
commit
|
commitdiff
|
tree
2014-10-26
Roland Schu
l
z
Add Windows support for host-/us
e
rname
commit
|
commitdiff
|
tree
2014-10-22
Ro
l
and
Schu
l
z
Remov
e
Cata
m
ount cmake
commit
|
commitdiff
|
tree
2014-10-21
Roland Schu
l
z
F
i
x
C++11 flags for
MingW
commit
|
commitdiff
|
tree
2014-10-20
Roland Schulz
C
r
ea
t
e scoped_
c
ptr to replac
e
scoped_ptr_sfree
commit
|
commitdiff
|
tree
2014-10-20
Roland
S
ch
u
lz
Used IWYU
to partially clean up
some inc
l
u
d
e
s
commit
|
commitdiff
|
tree
2014-10-12
Ro
l
a
nd Schulz
Fix misidentification
o
f
d
o
t in path name
commit
|
commitdiff
|
tree
2014-10-05
Roland Sc
h
ulz
A
llow runA
s
MainSi
n
g
l
eModule to be cal
l
ed more t
h
an
.
.
.
commit
|
commitdiff
|
tree
2014-09-29
Roland Schulz
Clarif
y
GCC+W
i
n
+AVX
w
a
rning
commit
|
commitdiff
|
tree
2014-09-29
R
o
land Sc
h
ul
z
M
erge r
e
le
a
s
e-4-6 into r
e
lease-5-0
commit
|
commitdiff
|
tree
2014-09-23
Roland Schulz
Fix IC
C
warni
n
gs
commit
|
commitdiff
|
tree
2014-09-22
Roland Sc
h
ulz
F
i
x m
e
s
sage abou
t
incorrect usage of dihedr
a
l type 9
commit
|
commitdiff
|
tree
2014-09-21
R
ol
a
nd Schulz
Merge releas
e
-
5
-0 int
o
master
commit
|
commitdiff
|
tree
2014-09-20
Roland Schulz
M
inor performance impromen
t
s
commit
|
commitdiff
|
tree
2014-09-18
R
o
la
n
d Schulz
Fix double
lin
k
age f
o
r
tests
commit
|
commitdiff
|
tree
2014-09-17
Roland Sch
u
lz
A
dd mi
s
sing quotes
commit
|
commitdiff
|
tree
2014-09-17
Rol
a
nd Schulz
Fi
x
shared libs for Mingw
commit
|
commitdiff
|
tree
2014-09-17
Roland
Schulz
M
e
rge rele
a
se
-
5
-
0
into master
commit
|
commitdiff
|
tree
2014-09-17
Roland Schulz
Remove n
o
-inline-max-si
z
e
and suppr
e
s
s remark
commit
|
commitdiff
|
tree
2014-09-17
R
o
l
a
nd Schulz
Va
l
grind s
u
ppr
e
ss
i
on for
OS X 1
0
.
9
commit
|
commitdiff
|
tree
2014-09-16
Roland Schulz
F
i
x warning
s
for I
C
C 15
commit
|
commitdiff
|
tree
2014-09-14
R
o
lan
d
Schulz
Remove unnecessary cppcheck inclu
d
e-path
commit
|
commitdiff
|
tree
2014-09-11
Ro
l
and
Schulz
Fix so
r
ting
a
n
d doxygen
commit
|
commitdiff
|
tree
2014-09-10
R
oland
Schulz
Me
r
ge rel
e
ase-
5
-0 in
t
o
master
commit
|
commitdiff
|
tree
2014-09-07
Roland
S
chulz
Remo
v
e some include order de
p
en
d
e
n
c
i
es
commit
|
commitdiff
|
tree
2014-09-07
Roland
Schulz
Fix build for ex
t
ernal boost 1
.
56
.
0
commit
|
commitdiff
|
tree
2014-09-07
Ro
l
and
Schulz
Simplify AVX integer load/store
commit
|
commitdiff
|
tree
2014-09-05
R
o
l
a
nd Sch
u
lz
Fix build f
o
r external
b
oost 1
.
5
6
.
0
commit
|
commitdiff
|
tree
2014-09-05
Rolan
d
S
c
hulz
Merge release-5-
0
into
m
a
st
e
r
commit
|
commitdiff
|
tree
2014-09-04
Roland
S
chulz
Add Mingw wa
r
nings
commit
|
commitdiff
|
tree
2014-09-04
Roland Schulz
Slight s
i
mpl
i
f
cation of 2xnn
commit
|
commitdiff
|
tree
2014-09-03
R
o
l
a
n
d Schulz
M
e
rge release-5-0 into master
commit
|
commitdiff
|
tree
2014-09-03
Rol
a
nd
S
chulz
Fix MingW build
commit
|
commitdiff
|
tree
2014-09-03
Roland Schulz
Fix that TNG tests w
e
re not run
commit
|
commitdiff
|
tree
2014-09-02
Roland Schulz
Fix P
R
INT_AL
L
O
C
_KB output
commit
|
commitdiff
|
tree
2014-08-25
Roland
Schulz
Merge release-5-0 into master
commit
|
commitdiff
|
tree
2014-08-20
Roland Schulz
Ch
a
nge error
to wa
r
ning for missing OMP_NUM_TH
R
EADS
commit
|
commitdiff
|
tree
2014-08-18
R
oland
S
c
hulz
Fix nbnxn templates
commit
|
commitdiff
|
tree
2014-08-18
Rolan
d
Schulz
A
d
d
I
n
tel command line warning
commit
|
commitdiff
|
tree
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