repo.or.cz
/
gromacs.git
/
search
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
log
|
graphiclog1
|
graphiclog2
|
commit
|
commitdiff
|
tree
|
refs
|
edit
|
fork
first
·
prev
·
next
Removed unnecessary static declarations for command-line parsing
2017-07-11
Roland Schul
z
PME-gather: make variables
l
o
cal
and const
commit
|
commitdiff
|
tree
2017-06-28
Roland
S
chu
l
z
Merge "
M
erge branch re
l
ease-20
1
6"
commit
|
commitdiff
|
tree
2017-06-28
Roland Sch
u
lz
Fix ICC workaround for C++
1
1 feature check
commit
|
commitdiff
|
tree
2017-06-27
R
o
land Schulz
Merg
e
branch release-2016
commit
|
commitdiff
|
tree
2017-05-22
Roland
Schulz
Remo
v
e
TMPI_ATOMICS from
con
f
i
g
.
h
commit
|
commitdiff
|
tree
2017-05-11
Ro
l
an
d
Schulz
R
emove
s
tatic-intel from default f
l
a
g
s
commit
|
commitdiff
|
tree
2017-02-23
Rola
n
d Sch
u
lz
Fix c
o
mpile of GMX_SIMD=None wi
t
h ICC
commit
|
commitdiff
|
tree
2017-02-10
Roland Schulz
Remove duplicate AVX512
gather d
e
f
i
n
itions
commit
|
commitdiff
|
tree
2017-02-08
Roland Schulz
AVX51
2
: Use do
u
ble-sized gather fo
r
pairs of floats
commit
|
commitdiff
|
tree
2017-01-20
Roland Schulz
F
ix missing
b
reak in switch
commit
|
commitdiff
|
tree
2017-01-18
Rola
n
d S
c
hulz
A
dd AlignedA
r
r
a
y
commit
|
commitdiff
|
tree
2017-01-13
R
o
l
and
S
chu
l
z
Enable uncrust
i
fy for
t
e
m
plate
commit
|
commitdiff
|
tree
2017-01-11
Rolan
d
S
c
hul
z
T
i
d
y: modernize-use-nullptr
commit
|
commitdiff
|
tree
2017-01-10
Roland Schulz
Fix AVX512 issues in debu
g
mo
d
e
commit
|
commitdiff
|
tree
2017-01-05
R
o
land
S
chulz
Supress ICC 16 on Windows false p
o
st
i
ves
commit
|
commitdiff
|
tree
2017-01-05
Roland Schu
l
z
Fi
x
copyri
g
ht year of previ
o
us
commi
t
commit
|
commitdiff
|
tree
2017-01-05
Roland Schulz
Fix unit
i
alize
d
memory acces
s
commit
|
commitdiff
|
tree
2016-12-15
Roland Sc
h
u
l
z
Add
creat
e
_un
i
que_with_deleter
commit
|
commitdiff
|
tree
2016-12-15
Ro
l
and Schulz
Replace s
c
oped_cp
t
r with unique_cptr
commit
|
commitdiff
|
tree
2016-11-03
Roland Schu
l
z
Supress ICC 16 on Windows false
postive
s
commit
|
commitdiff
|
tree
2016-10-30
Ro
l
and Schulz
Replace qso
r
t/bsearch wit
h
std::sort/low
e
r_bound
commit
|
commitdiff
|
tree
2016-10-21
R
oland
S
chulz
Supp
r
ess cppche
c
k warning
commit
|
commitdiff
|
tree
2016-09-18
Rol
a
nd Schul
z
Fix math
-
test false positive
commit
|
commitdiff
|
tree
2016-09-18
R
ol
a
nd Schulz
B
e
tter
o
ptimized ICC release flags
commit
|
commitdiff
|
tree
2016-09-13
Rola
n
d Schulz
Tid
y
: m
o
d
ern
i
ze-use-e
m
p
l
ace
commit
|
commitdiff
|
tree
2016-08-27
R
o
la
n
d
S
chulz
Fix build with GMX_USE_TNG=off
commit
|
commitdiff
|
tree
2016-08-24
Roland Schulz
R
em
o
v
e unnecessary ICC warning s
u
ppres
s
ion
commit
|
commitdiff
|
tree
2016-07-30
Roland
Schulz
Update GCC version for
r
efere
n
ce build
commit
|
commitdiff
|
tree
2016-07-23
Rolan
d
Schulz
Merge release-2016 into m
a
ster
commit
|
commitdiff
|
tree
2016-07-18
Ro
l
and Schulz
Fix non-parallel
b
uild
commit
|
commitdiff
|
tree
2016-06-02
R
o
land Schulz
Fix ICC 16u3 build
commit
|
commitdiff
|
tree
2016-05-28
Rol
a
nd Schu
l
z
F
i
x build with
clang 3
.
1+3
.
2
commit
|
commitdiff
|
tree
2016-05-17
Roland Schulz
Ad
d
r
eference to Top
o
T
ools 1
.
6
commit
|
commitdiff
|
tree
2016-05-13
Roland Schulz
D
on't use abort
for
f
a
tal errors
commit
|
commitdiff
|
tree
2016-05-10
Roland Schu
l
z
Add OpenMP fo
r
funct
i
ons
l
imit
i
ng scalin
g
commit
|
commitdiff
|
tree
2016-04-28
R
o
land Schulz
Merge "
M
erge bra
n
ch release-5-
1
"
commit
|
commitdiff
|
tree
2016-04-26
Rolan
d
Schul
z
Fix numeric
a
lly unstable Gaussian test
commit
|
commitdiff
|
tree
2016-04-19
Roland Sc
h
ulz
Fix numer
i
cally
unstable
se
l
ection test
commit
|
commitdiff
|
tree
2016-04-19
Roland Schulz
Tune
n
stlist in
c
r
ease for KNL
commit
|
commitdiff
|
tree
2016-04-15
Roland
S
chu
l
z
Fix AVX512
s
uggestion
commit
|
commitdiff
|
tree
2016-04-15
Ro
l
a
n
d
Schulz
Remove
idio
m
s deprecated in
C
+
+11
commit
|
commitdiff
|
tree
2016-04-06
R
o
land Sch
u
lz
AVX512
transpo
s
e
S
catter
I
ncr/De
c
r
U wit
h
load/store
commit
|
commitdiff
|
tree
2016-04-02
R
o
land Schulz
Fix
coolq
u
o
tes
commit
|
commitdiff
|
tree
2016-03-11
R
o
land Schulz
Fix MPI_
I
N_PLACE t
e
st
commit
|
commitdiff
|
tree
2016-03-10
Roland Schulz
Improve
AVX5
1
2
commit
|
commitdiff
|
tree
2015-12-27
Roland S
c
hulz
Fix G++ 4
.
7
.
0
commit
|
commitdiff
|
tree
2015-12-08
R
o
l
a
nd
S
chulz
Remove old
MSVC references
commit
|
commitdiff
|
tree
2015-09-30
Roland Schulz
R
e
q
uire C++11
commit
|
commitdiff
|
tree
2015-09-30
Roland Sch
u
lz
Manually
p
r
o
p
a
g
a
te CUDA host c
o
mpi
l
er flags
commit
|
commitdiff
|
tree
2015-09-27
R
o
land Schulz
Converted 4xn kernel to
C
++
commit
|
commitdiff
|
tree
2015-09-23
Roland
S
c
h
ulz
B
u
m
p required CUDA
version fro
m
4
.
0+ to 5
.
0+
commit
|
commitdiff
|
tree
2015-08-15
Roland Schu
l
z
Fix Clang warning
commit
|
commitdiff
|
tree
2015-08-07
R
o
land
S
c
hulz
Fi
x
VS2015
w
arning
commit
|
commitdiff
|
tree
2015-08-07
Roland Schulz
Fix missing in
c
lude
commit
|
commitdiff
|
tree
2015-08-06
Rola
n
d Schulz
Replace AI,
A
J,
.
.
and C0,
C
1, C2 m
a
c
r
o
s with functions
commit
|
commitdiff
|
tree
2015-07-28
Rola
n
d
Schu
l
z
C
o
n
ver
t
ed 2x
n
n kernel to C++
commit
|
commitdiff
|
tree
2015-07-11
Ro
l
and S
c
hulz
Update k
e
r
n
el templates to matc
h
kernels
commit
|
commitdiff
|
tree
2015-07-09
Roland
Schulz
New quotes
commit
|
commitdiff
|
tree
2015-07-08
R
olan
d
Schulz
Mer
g
e r
e
l
ease-5-1 into m
a
ster
commit
|
commitdiff
|
tree
2015-07-08
Roland Schulz
Merge release-
5
-
0
i
nt
o
release-5-1
commit
|
commitdiff
|
tree
2015-07-08
Roland Schulz
Merge releas
e
-4-6 into release-5-0
commit
|
commitdiff
|
tree
2015-06-28
Roland Schulz
Remove
u
nused cm
a
ke
f
iles
commit
|
commitdiff
|
tree
2015-06-28
R
o
la
n
d Schulz
Don't use check
_
libra
r
y for libm
commit
|
commitdiff
|
tree
2015-06-25
R
oland Schulz
Fi
x
Wundef warni
n
gs
commit
|
commitdiff
|
tree
2015-06-22
Rola
n
d Sch
u
lz
Fix
G
MX_AL
I
GNMENT for MSVC 2012
and
2
013
commit
|
commitdiff
|
tree
2015-06-22
R
oland Schulz
Fix
c
m
a
ke 3
.
1 w
a
r
n
ings with MSVC
commit
|
commitdiff
|
tree
2015-06-19
Rolan
d
Schulz
Fix
missing include
commit
|
commitdiff
|
tree
2015-06-16
Roland S
c
hulz
Fi
x
warning in uncrustify
commit
|
commitdiff
|
tree
2015-06-16
Roland
S
c
hulz
Fi
x
consts
in
bonded and
c
lincs
commit
|
commitdiff
|
tree
2015-06-06
Roland
Schulz
Use stat to check th
a
t
pa
t
h
s
a
re
e
quiva
l
e
n
t
commit
|
commitdiff
|
tree
2015-06-05
Rolan
d
Schulz
Merge releas
e
-5-0 into master
commit
|
commitdiff
|
tree
2015-06-05
Roland Sc
h
ulz
Reenable
l
i
n
cs/bon
d
ed SIMD
for ICC on Win
d
ow
s
commit
|
commitdiff
|
tree
2015-06-03
Roland S
c
hulz
Use stack bu
f
fer for L
I
NCS&bonde
d
gat
h
er
/
scatter
commit
|
commitdiff
|
tree
2015-05-30
Roland
Schulz
Work-around for ICC
15 on
P
h
i
commit
|
commitdiff
|
tree
2015-05-26
Roland
S
c
h
ulz
D
on't se
t
CFLAGS
for Phi in tool
c
hain
commit
|
commitdiff
|
tree
2015-05-13
Roland Schulz
Faci
l
itate
l
ink
i
ng of
s
t
a
tic bin
a
ries
commit
|
commitdiff
|
tree
2015-03-17
Roland Schulz
Fix linking with static li
b
x
m
l2
commit
|
commitdiff
|
tree
2015-03-04
Roland Schulz
Fix GCC5 warnings
commit
|
commitdiff
|
tree
2015-03-03
Rola
n
d Schulz
nbnxn uti
l
s p
e
r
f
or
m
ance improvement for
Phi
commit
|
commitdiff
|
tree
2015-03-02
Rolan
d
Schulz
D
o
n't s
e
a
r
ch installa
t
ion prefix if bi
n
ary is not
f
ound
commit
|
commitdiff
|
tree
2015-02-25
Rola
n
d S
c
h
u
lz
C++ conversion for PME spread/gather
commit
|
commitdiff
|
tree
2015-02-12
R
o
l
and Sc
h
ulz
Merge release-5-0 into master
commit
|
commitdiff
|
tree
2015-02-12
Roland Schulz
Me
r
ge release-4-6 int
o
release-5-0
commit
|
commitdiff
|
tree
2015-02-10
Roland Sch
u
lz
D
on't se
t
CFL
A
GS for Phi in t
o
olchain
commit
|
commitdiff
|
tree
2015-02-10
Roland
S
ch
u
lz
Work
-
arou
n
d
fo
r
ICC
1
5
on P
h
i
commit
|
commitdiff
|
tree
2015-02-07
Rolan
d
Schu
l
z
Make
Fin
d
Boost q
u
ite
commit
|
commitdiff
|
tree
2015-02-02
Ro
l
an
d
Schulz
Fix
F
P
exception
i
n FE
commit
|
commitdiff
|
tree
2015-01-27
R
oland Schulz
Workaro
u
nd for
MemorySani
t
ize
r
commit
|
commitdiff
|
tree
2015-01-27
Rola
n
d Sc
h
ulz
Fix u
n
i
tl
i
zed memory
r
e
a
d in
chec
k
p
o
i
nt
commit
|
commitdiff
|
tree
2015-01-05
Roland Schul
z
Enable fp
-
exceptio
n
s
commit
|
commitdiff
|
tree
2014-12-18
R
ola
n
d Schulz
Fix CMP0054 cmake
3
.
1
.
0 warnings
commit
|
commitdiff
|
tree
2014-12-17
Roland Sch
u
lz
M
e
rge "Merge branch '
r
ele
a
s
e-5-0'"
commit
|
commitdiff
|
tree
2014-12-17
Ro
l
and Schulz
Fix cppch
e
c
k
-1
.
6
7
warnings
commit
|
commitdiff
|
tree
2014-12-15
Ro
l
and
Sc
h
ulz
Fix NVML detection on Windows
commit
|
commitdiff
|
tree
2014-12-13
Roland
Schu
l
z
U
se bitmas
k
f
or bon
d
e
d
commit
|
commitdiff
|
tree
2014-12-07
Rol
a
nd Schul
z
Merg
e
release-5
-
0 into master
commit
|
commitdiff
|
tree
2014-11-26
Ro
l
a
nd
S
chulz
Fix clang with boost 1
.
46
.
1
a
nd 1
.
4
7
commit
|
commitdiff
|
tree
2014-11-26
Roland
Schulz
Me
r
g
e release-5-0 into
m
aster
commit
|
commitdiff
|
tree
2014-11-23
Roland Schulz
S
et
GMX
_
SIMD
to
MIC f
o
r Xeon Phi
commit
|
commitdiff
|
tree
2014-11-12
Roland S
c
hulz
Use stat to check tha
t
p
a
ths are e
q
uivalent
commit
|
commitdiff
|
tree
next