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Remove individual cuda libraries
2013-10-18
Roland Schulz
Fix tMPI_At
o
m
ic_memor
y
_ba
r
rier for
M
IC
commit
|
commitdiff
|
tree
2013-10-17
Roland Schu
l
z
Fix SIMD
C
referenc
e
nbnxn kernels
commit
|
commitdiff
|
tree
2013-07-24
Roland Schulz
M
e
rge "Me
r
ge branch release-4-6 into m
a
s
t
er"
commit
|
commitdiff
|
tree
2013-06-27
Roland Schulz
M
e
rge b
r
anch 'release-4-6' into master
commit
|
commitdiff
|
tree
2013-06-27
Rolan
d
Schulz
Merge b
r
anch
'
re
l
ease-4-6' int
o
master
commit
|
commitdiff
|
tree
2013-06-26
Roland Schulz
Remove
h
ack to supp
o
rt old
v
ersion
t
pr v
e
rsion 80
commit
|
commitdiff
|
tree
2013-05-21
Roland Schulz
Merge
r
eleas
e
-4-6 into master
commit
|
commitdiff
|
tree
2013-03-26
Roland Schul
z
Merge release-4-5-patches into release-4-6
commit
|
commitdiff
|
tree
2013-03-22
Rol
a
n
d S
c
h
u
lz
F
ix
p
rob
l
ems wi
t
h int
e
l
-mpi
commit
|
commitdiff
|
tree
2013-03-20
Roland Schul
z
Merge rel
e
a
s
e-4-6
i
n
t
o master
commit
|
commitdiff
|
tree
2013-03-06
Roland Schulz
Merge "fix
e
d P
M
E time print with -ntomp_
p
me != -ntomp
.
.
.
commit
|
commitdiff
|
tree
2013-03-05
R
oland Schulz
Fix
e
s linkage with FFTW + MKL for
BL
A
S/
L
APACK
commit
|
commitdiff
|
tree
2013-02-26
Roland Sc
h
ulz
M
erge release
-
4-6 into maste
r
commit
|
commitdiff
|
tree
2013-02-18
R
oland Schulz
Is
s
ue errors/wa
r
ning
s
for ICC bef
o
re 12
.
0
.
0
commit
|
commitdiff
|
tree
2013-02-16
Roland Schulz
Add
m
issin
g
incl
u
de
commit
|
commitdiff
|
tree
2013-02-13
Roland Sc
h
u
l
z
M
e
rge
"
Fi
x
e
d the MPI recognitio
n
string in
g_tune_pme
.
.
.
commit
|
commitdiff
|
tree
2013-02-13
Rola
n
d
S
c
hulz
M
erg
e
"
i
mprove setup of multiple
tf t
a
b
l
es" into release-
4
-
6
commit
|
commitdiff
|
tree
2013-02-13
Roland Schul
z
Me
r
ge release-4-6 into master
commit
|
commitdiff
|
tree
2013-02-13
Rol
a
nd Sc
h
u
lz
Me
r
ge release-4-6
i
nto m
a
ster
commit
|
commitdiff
|
tree
2013-02-13
Ro
l
and Sc
h
ulz
Code b
e
autif
i
cation with uncrustify
commit
|
commitdiff
|
tree
2013-02-13
Roland Schulz
Me
r
ge "Updated
FindGSL
.
c
make to versio
n
written by
.
.
.
commit
|
commitdiff
|
tree
2013-02-09
Roland Schulz
Me
r
ge "Ty
p
o
f
ix" into rel
e
ase-4-6
commit
|
commitdiff
|
tree
2013-02-08
Roland Sc
h
ulz
Fix
CU
D
A_HOST_COMPILER
flag name
commit
|
commitdiff
|
tree
2013-02-08
Roland Schu
l
z
Remove duplicated clang section
commit
|
commitdiff
|
tree
2013-02-08
Rola
n
d Schulz
Remove
du
m
my
.
cpp
commit
|
commitdiff
|
tree
2013-01-30
Roland Schul
z
Fix
g
m
x
c
h
e
ck target
commit
|
commitdiff
|
tree
2013-01-22
Roland Schu
l
z
Il
l
egal
a
cceleratio
n
default
e
d to QPX
commit
|
commitdiff
|
tree
2013-01-22
Roland S
c
hulz
Fix T
O
UPPER usage
commit
|
commitdiff
|
tree
2013-01-22
Rolan
d
S
chulz
Updated
h
tml manu
a
l
to 4
.
6
commit
|
commitdiff
|
tree
2013-01-21
Rolan
d
Schulz
Mer
g
e
r
elea
s
e
-4-
6
i
n
t
o master
commit
|
commitdiff
|
tree
2013-01-20
Roland Schulz
Merge release-4-6 into mas
t
er
commit
|
commitdiff
|
tree
2013-01-19
Ro
l
an
d
S
chulz
Fix A
V
X
double compile er
r
or
commit
|
commitdiff
|
tree
2013-01-19
Ro
l
and Schulz
A
d
d fftpack to EXTRA_DIST
commit
|
commitdiff
|
tree
2013-01-19
Roland Schulz
Release 4
.
5
.
6
commit
|
commitdiff
|
tree
2013-01-18
Roland Schu
l
z
Mer
g
e re
l
ease-
4
-5-patc
h
e
s
into releas
e
-4-
6
commit
|
commitdiff
|
tree
2013-01-18
Rola
n
d Sc
h
u
l
z
Fix typo
commit
|
commitdiff
|
tree
2013-01-18
Roland Schulz
Code beautification with uncrustify
commit
|
commitdiff
|
tree
2013-01-18
Ro
l
an
d
S
chul
z
Add colon a
f
t
er macro to he
l
p
u
ncrustify
commit
|
commitdiff
|
tree
2013-01-18
Ro
l
a
n
d Schul
z
Fix reading of
g
96 title
commit
|
commitdiff
|
tree
2013-01-17
Ro
l
and Schul
z
Merge "Mer
g
e bran
c
h 'release-4-5-patc
h
es' into rel
e
ase
.
.
.
commit
|
commitdiff
|
tree
2013-01-17
Roland Schulz
Remove unnecessary I
C
C f
l
ags
a
ffecting performan
c
e
commit
|
commitdiff
|
tree
2013-01-17
Roland Schulz
Merg
e
"clarify w
o
rding
o
f GPU driver-rela
t
ed note
s
.
.
.
commit
|
commitdiff
|
tree
2013-01-17
Rolan
d
S
c
h
u
lz
Merge
"Added check
for v
a
lid wal
l
_atom
t
ype in
.
mdp
.
.
.
commit
|
commitdiff
|
tree
2013-01-17
Rola
n
d
Schu
l
z
Run
r
e
g
ressiontes
t
s fr
o
m build
commit
|
commitdiff
|
tree
2013-01-17
R
oland Schulz
Fix confusing gmx_hea
d
er_
c
onfig
.
h inc
l
ude
commit
|
commitdiff
|
tree
2013-01-16
R
oland Schul
z
D
on
'
t cache $
{
FFTW}_HAVE_(SIMD|AVX)
commit
|
commitdiff
|
tree
2013-01-15
Rol
a
nd Schulz
Merge release-4-6 into master
commit
|
commitdiff
|
tree
2013-01-15
Roland Schul
z
F
ix missing re
p
laceme
n
t/typo
commit
|
commitdiff
|
tree
2013-01-13
Roland Schulz
Merge "Fi
x
es for md-vv an
d
r
erun" in
t
o rel
e
ase-4-6
commit
|
commitdiff
|
tree
2013-01-13
Ro
l
and Schulz
Merg
e
"fixed
r
esetting states with parallel Verlet
.
.
.
commit
|
commitdiff
|
tree
2013-01-13
Roland Schulz
Proper f
i
x for co
p
yrite cuda dependence
commit
|
commitdiff
|
tree
2013-01-13
Roland Schul
z
Merge "pr
e
p
a
red the nbnxn code for no
n
-x86 SIMD" into
.
.
.
commit
|
commitdiff
|
tree
2013-01-11
Rolan
d
Sch
u
lz
M
erge "time the
G
PU force clearing async
laun
c
h ov
e
rhead
.
.
.
commit
|
commitdiff
|
tree
2013-01-11
Roland Schul
z
M
e
rge releas
e
-4-
5
-patches into
r
e
l
e
ase-4-
6
commit
|
commitdiff
|
tree
2013-01-11
R
oland S
c
hulz
Adde
d
missing export
commit
|
commitdiff
|
tree
2013-01-11
Roland Sch
u
lz
Merg
e
"Handle compiler flags more flexibly
"
into release-4-6
commit
|
commitdiff
|
tree
2013-01-10
Roland
S
chulz
R
emove inc
o
rrect assert
add
e
d by 05f9a
7
40
commit
|
commitdiff
|
tree
2013-01-10
Ro
l
a
n
d Schulz
Han
d
le
c
ompiler flags mo
r
e
flexi
b
ly
commit
|
commitdiff
|
tree
2013-01-10
Roland Schu
l
z
M
e
rge "Move Wi
n
d
o
ws share
d
/static opt
i
o
ns to later
.
.
.
commit
|
commitdiff
|
tree
2013-01-10
Roland S
c
h
ulz
Merge "
R
e
m
ov
e
workaroun
d
" into release-4-6
commit
|
commitdiff
|
tree
2013-01-10
Roland Schulz
Move W
i
nd
o
ws
s
hared/sta
t
ic option
s
to later poin
t
commit
|
commitdiff
|
tree
2013-01-10
Rolan
d
S
c
hu
l
z
Remove
w
o
r
karound
commit
|
commitdiff
|
tree
2013-01-09
Rolan
d
Schulz
Me
r
ge "Added wor
k
-
around for gcc bug
in
AV
X
intrinsincs
.
.
.
commit
|
commitdiff
|
tree
2013-01-09
Roland
Schulz
Me
r
ge "
A
dd check to
r
emove
z
ero C
h
armm d
i
hedrals"
into
.
.
.
commit
|
commitdiff
|
tree
2013-01-09
Roland
Schulz
Merge "
[
tools] g_sa
n
s - add tra
j
ectory avereging" into
.
.
.
commit
|
commitdiff
|
tree
2013-01-08
Roland Schul
z
Merge
"
R
e
duce use
o
f
monolit
h
ic sets of c
o
mpiler flags
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
Roland Schu
l
z
Merge "fixed nb
n
xn AVX-256 Ewald table pointer
a
lignm
e
n
t
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
R
o
land Sc
h
ulz
Merge "cmake: remove doubl
e
-ne
g
a
tive quotes logic"
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
Roland Schulz
Merge "Print out
a
tom numb
e
rs in g_rm
s
f" into
relea
s
e
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
R
o
land
S
chulz
Fix CUDA being quiet and mark all CU
D
A_* as ad
v
anc
e
d
commit
|
commitdiff
|
tree
2013-01-07
Roland Schul
z
M
e
rge "Ignor
e
bool
c
ast
w
arning for
M
SVC and C++" into
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
Ro
l
and
S
ch
u
lz
Merge "im
p
rov
e
d
r
eporting of failed affinity se
t
ting
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
Ro
l
a
nd Schulz
Merge
"Fi
x
e
d
forma
t
er
r
o
r in online manual
.
" into release-
4
-6
commit
|
commitdiff
|
tree
2013-01-07
Roland Schul
z
Merge "
F
ixed a
b
ug that
w
ith multiple exc
h
a
n
ge
s
" in
t
o
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
Roland
S
chulz
M
e
rge "Esse
n
tial dynamics: fix
e
d restarts
w
hen ED gro
u
p
.
.
.
commit
|
commitdiff
|
tree
2013-01-07
Roland Sch
u
lz
Merge "minor speed-
u
p an
d
c
od
e
cl
e
an
-
up in nbnxn kernels
.
.
.
commit
|
commitdiff
|
tree
2013-01-03
Roland Sc
h
ulz
Merg
e
"
Fix
e
d
G
MXRC
s
o
we
a
re
not p
o
l
l
uting
s
ta
n
dar
d
.
.
.
commit
|
commitdiff
|
tree
2012-12-22
Rol
a
nd Schu
l
z
Add missing visibility ex
p
orts
commit
|
commitdiff
|
tree
2012-12-21
Roland Schulz
Ignore bool cast warning for MSV
C
and C++
commit
|
commitdiff
|
tree
2012-12-20
R
oland Schul
z
Merge
rele
a
s
e
-4-6 in
t
o
ma
s
te
r
commit
|
commitdiff
|
tree
2012-12-19
Roland Schulz
Merge
"Fix license te
x
t printed by programs
.
" int
o
.
.
.
commit
|
commitdiff
|
tree
2012-12-19
Roland Schulz
Merge changes Idc652236,
I
f03cf56
9
in
t
o
r
e
l
eas
e
-4
-
6
commit
|
commitdiff
|
tree
2012-12-19
Rola
n
d S
c
h
u
lz
Mer
g
e "issue er
r
o
r
if GPU ID
is pr
o
vided
w
ith GPU acc
.
.
.
commit
|
commitdiff
|
tree
2012-12-12
Rola
n
d
Schulz
Merge release-4-6 i
n
to
master
commit
|
commitdiff
|
tree
2012-12-09
Roland Schulz
Merge "fixed GPU pair-search
w
ith GMX_
C
P
U
_ACC
E
LERA
T
ION
.
.
.
commit
|
commitdiff
|
tree
2012-12-09
Roland Schulz
Merge
"Fix build of templa
t
e and o
t
her extern
a
l code
.
.
.
commit
|
commitdiff
|
tree
2012-12-08
Roland Sch
u
lz
Fix compi
l
ation with P
G
I
commit
|
commitdiff
|
tree
2012-12-06
Roland Sc
h
u
lz
Make
S
SE4
.
1 w
a
rning clea
r
er
commit
|
commitdiff
|
tree
2012-12-05
Ro
l
and Sch
u
l
z
Merge "fixed segv in Ve
r
let pair-search with trili
n
i
c
.
.
.
commit
|
commitdiff
|
tree
2012-12-05
R
o
land
S
c
hulz
Merge "f
i
x
e
d
inco
r
re
c
t virial
with virtual sites and
.
.
.
commit
|
commitdiff
|
tree
2012-12-05
Roland
Schulz
Remove TEST_TMPI_ATOMICS_
O
NLY
commit
|
commitdiff
|
tree
2012-12-03
Ro
l
a
nd Schu
l
z
Me
r
ge releas
e
-
4-6 int
o
master
commit
|
commitdiff
|
tree
2012-11-28
R
o
land S
c
hulz
Merge "Remov
e
C
V
S fil
e
s" into
re
l
ease
-
4-6
commit
|
commitdiff
|
tree
2012-11-28
Roland Schulz
F
i
x
cpac
k
s
r
c
ignore rule
commit
|
commitdiff
|
tree
2012-11-28
Ro
l
and Schulz
F
i
x: pt
h
read variables wer
e
overwritten by gmxManageGPU
commit
|
commitdiff
|
tree
2012-11-28
Roland Schulz
Fix
CPACK
_
SOUR
C
E_IGNORE_FILES
commit
|
commitdiff
|
tree
2012-11-28
Rolan
d
Schulz
Pri
n
t error
i
f
no thread support is available
commit
|
commitdiff
|
tree
2012-11-27
Roland Schul
z
Fix Window-GPU b
u
ild
commit
|
commitdiff
|
tree
2012-11-27
Roland Schulz
R
emove C
V
S files
commit
|
commitdiff
|
tree
2012-11-27
Roland Schulz
Add visibility
defines
commit
|
commitdiff
|
tree
next