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Add AMD image build, v2
2020-01-08
Roland Schulz
Merge r
e
lease-2
0
19 i
n
to release-2020
commit
|
commitdiff
|
tree
2020-01-07
Rola
n
d
Schul
z
Workaroun
d
for
I
CC 19u5 and
2
0in
i
ti
a
l
commit
|
commitdiff
|
tree
2020-01-07
Rola
n
d Schu
l
z
Add supp
o
rt fo
r
ICC NextGen with MKL
commit
|
commitdiff
|
tree
2019-03-28
Roland Schulz
Fix UB
v
e
c
t
o
r usage
commit
|
commitdiff
|
tree
2019-03-27
Roland
S
chulz
Fix UB v
e
ctor usage
commit
|
commitdiff
|
tree
2019-03-08
Roland Schulz
Fix
I
CC warnings
commit
|
commitdiff
|
tree
2019-03-01
Roland S
c
hulz
Improv
e
documentation links
commit
|
commitdiff
|
tree
2019-02-19
R
o
land Schulz
Add GMX_OCL_SHOW_DIAGNOSTICS env op
t
ion
commit
|
commitdiff
|
tree
2019-02-19
Rola
n
d
S
chulz
Im
p
rove li
b
std++ handling
commit
|
commitdiff
|
tree
2019-02-11
Roland Schulz
R
e
mo
v
e
E
mp
t
yArrayRef
commit
|
commitdiff
|
tree
2019-02-08
Roland Schulz
Fix
s
ign
w
arning
commit
|
commitdiff
|
tree
2019-02-07
Rol
a
nd Schulz
R
e
v
er
t
size to be
u
nsigned for A
r
ra
y
Ref
commit
|
commitdiff
|
tree
2019-02-07
Roland Schulz
A
d
d
s
size and remove st
a
tic_casts
commit
|
commitdiff
|
tree
2019-02-04
Roland Schulz
Re
n
ame all sour
c
e
fil
e
s from -
to _
f
o
r
consi
s
tency
.
commit
|
commitdiff
|
tree
2019-02-04
Rol
a
nd Sc
h
ulz
F
i
x
cmake
p
oli
c
y
warning
commit
|
commitdiff
|
tree
2019-02-04
Rol
a
nd Schulz
Replac
e
c
o
mpat::make_un
i
que wi
t
h std::make_unique
commit
|
commitdiff
|
tree
2019-02-02
Roland Schulz
Fix Inte
l
com
p
ile
r
on
Win
d
ow
s
build
commit
|
commitdiff
|
tree
2019-02-02
Roland Schulz
Rena
m
ed
l
i
sted
-
forc
e
s to
l
ist
e
d_forc
e
s
commit
|
commitdiff
|
tree
2019-02-02
Roland Sch
u
lz
Remove
r
eliance on inconsistent cmake feature testing
commit
|
commitdiff
|
tree
2019-02-02
Roland Schul
z
Ad
d
recommendation o
f
how to comp
i
le
w
ith MPI
commit
|
commitdiff
|
tree
2019-01-31
Roland
S
chulz
Fix clfft b
u
ild
commit
|
commitdiff
|
tree
2019-01-30
Rol
a
nd
S
chu
l
z
Change all C to C++
o
u
t
side of
TNG
commit
|
commitdiff
|
tree
2019-01-29
Rol
a
nd Schulz
A
dd cmak
e
C++14 feature check
commit
|
commitdiff
|
tree
2019-01-28
R
o
lan
d
S
c
hulz
Re
s
olve
C
++14
T
ODOs
commit
|
commitdiff
|
tree
2019-01-26
R
o
land Schulz
Fix clang warning
commit
|
commitdiff
|
tree
2019-01-26
R
oland Schulz
Fi
x
m
i
sc cla
n
g warni
n
gs
commit
|
commitdiff
|
tree
2019-01-25
Roland Schulz
Requir
e
C++14
commit
|
commitdiff
|
tree
2019-01-25
Ro
l
and Schulz
Work-aroun
d
for ICC
bug in simd-tests
commit
|
commitdiff
|
tree
2019-01-23
R
oland Sch
u
l
z
Merge release-2019 into mas
t
er
commit
|
commitdiff
|
tree
2019-01-23
Roland Schul
z
Merge r
e
leas
e
-20
1
8 into rele
a
s
e
-2019
commit
|
commitdiff
|
tree
2019-01-23
Roland Sch
u
lz
Rename gmx Variant to Any
commit
|
commitdiff
|
tree
2019-01-23
R
oland Schulz
Tur
n
System
A
t
o
mIt
e
rator into proper iterator
commit
|
commitdiff
|
tree
2019-01-15
Rolan
d
Sc
h
u
lz
Req
u
i
r
e c
m
ake 3
.
9
.
6
commit
|
commitdiff
|
tree
2018-12-13
Ro
l
and Schul
z
Remove
unu
s
ed MdrunC
o
mparisonFixtu
r
e
commit
|
commitdiff
|
tree
2018-11-16
R
o
land Schulz
M
e
rge releas
e
-2019 into m
a
st
e
r
commit
|
commitdiff
|
tree
2018-10-09
Roland
Schulz
Fi
x
MSAN errors
commit
|
commitdiff
|
tree
2018-10-08
Roland Schulz
OCL: Add const
to function arguments
commit
|
commitdiff
|
tree
2018-10-08
Roland Schulz
Add
O
CL k
e
rn
e
l t
a
rget
commit
|
commitdiff
|
tree
2018-10-08
Roland Schulz
Fix OCL compiler warnings
commit
|
commitdiff
|
tree
2018-10-08
Roland Schulz
Remove m
a
jority of
OCL co
m
ma
n
d lin
e
consta
n
ts
commit
|
commitdiff
|
tree
2018-10-05
Roland S
c
hulz
Fix multipl
e
b
u
gs det
e
cted on Windows
commit
|
commitdiff
|
tree
2018-10-05
Roland Schulz
OCL: Mak
e
variab
l
es
c
onst
commit
|
commitdiff
|
tree
2018-10-04
R
o
la
n
d
S
chulz
Use sub
g
roup f
o
r warp_an
y
and CJ4 pref
e
t
ch
commit
|
commitdiff
|
tree
2018-10-02
Roland
Schulz
Us
e
su
b
g
r
oup s
h
uff
l
e
f
or
r
ed
u
ction
commit
|
commitdiff
|
tree
2018-10-02
Ro
l
and Schulz
Na
r
row
s
c
ope
o
f I
C
C
compi
l
er wor
k
-aro
u
nd
commit
|
commitdiff
|
tree
2018-09-27
Rola
n
d Sc
h
u
lz
Recognize Intel
GPU as compatible
commit
|
commitdiff
|
tree
2018-09-21
R
oland
S
chulz
Fix clang-tidy
w
arn
i
ngs f
o
r clan
g
7
commit
|
commitdiff
|
tree
2018-09-18
R
o
land Sch
u
lz
Fix b
i
tmask p
r
i
nti
n
g
commit
|
commitdiff
|
tree
2018-09-15
R
oland Schulz
Replace sl
a
v
e
with agent
commit
|
commitdiff
|
tree
2018-09-14
Rolan
d
Schu
l
z
Warn for type mismatch
f
or gmx p
r
intf li
k
e
functi
o
ns 3/3
commit
|
commitdiff
|
tree
2018-09-13
Roland Schulz
R
emo
v
e sparc64
_
hpc_ac
e
n
o
nbonded k
e
rn
e
ls
commit
|
commitdiff
|
tree
2018-09-13
Ro
l
and Schulz
R
emove us
e
less comments
commit
|
commitdiff
|
tree
2018-09-12
R
o
la
n
d
Sch
u
l
z
Warn fo
r
ty
p
e mismatch f
o
r gm
x
printf like functio
n
s 2/3
commit
|
commitdiff
|
tree
2018-09-12
Rol
a
nd Schu
l
z
Add
S
SE2 + dou
b
le c
o
nf
i
g
commit
|
commitdiff
|
tree
2018-09-12
Roland Schulz
R
em
o
ve cpluscplus i
f
defs
commit
|
commitdiff
|
tree
2018-09-12
Rola
n
d Schulz
Fix clang-tidy warn
i
ngs for OCL
commit
|
commitdiff
|
tree
2018-09-11
Roland
S
chulz
Fix SSE4
.
1 af
t
er ch
a
nge to C++
commit
|
commitdiff
|
tree
2018-09-11
Ro
l
and Schulz
Compile nonbonde
d
kernels as C++
commit
|
commitdiff
|
tree
2018-09-10
Rola
n
d
S
chulz
Re
p
lace rounding using int(x+0
.
5) with roundToInt
commit
|
commitdiff
|
tree
2018-09-10
Roland
S
chulz
A
dd roundToInt
commit
|
commitdiff
|
tree
2018-09-07
Roland Schulz
clan
g
-ti
d
y
:
override
commit
|
commitdiff
|
tree
2018-09-07
Ro
l
and Schulz
Simplify Allocator
commit
|
commitdiff
|
tree
2018-09-06
Roland Schulz
HostAllocator: Remove unnec
e
ssary templat
e
commit
|
commitdiff
|
tree
2018-09-06
Rola
n
d Schulz
Remove p
i
n/u
n
pi
n
fro
m
HostAllocato
r
commit
|
commitdiff
|
tree
2018-09-06
R
o
land Schu
l
z
Change Can
B
ePinned to Pinne
d
IfSupp
o
rt
e
d
commit
|
commitdiff
|
tree
2018-09-05
R
ol
a
nd Schulz
Rem
o
v
e meta information from
h
o
st
a
llocator policy
commit
|
commitdiff
|
tree
2018-09-03
Roland
S
chu
l
z
Reduce duplicati
o
n in gpu_utils
commit
|
commitdiff
|
tree
2018-09-02
R
oland
S
chulz
Turn D
l
bState into scoped e
n
um
commit
|
commitdiff
|
tree
2018-08-29
Roland Schulz
Docume
n
t cla
n
g-tidy libs
t
dc++ inco
m
patibility
commit
|
commitdiff
|
tree
2018-08-29
R
oland Schulz
Use mor
e
cons
t
in ha
r
dwa
r
e
topology
commit
|
commitdiff
|
tree
2018-08-29
Rola
n
d Sch
u
lz
Fix clang-t
i
dy
b
uild
with libstdc++ >
=
7
commit
|
commitdiff
|
tree
2018-08-28
Roland Schulz
Add
h
a
rd limit for l
i
ne length
commit
|
commitdiff
|
tree
2018-08-27
Roland Sc
h
ulz
E
n
able m
o
r
e
c
l
ang-tidy checks for n
e
w code
commit
|
commitdiff
|
tree
2018-08-20
Roland Schulz
Remo
v
e macros in u
t
ili
t
y/tests/arrayref
commit
|
commitdiff
|
tree
2018-08-19
Rol
a
nd
S
c
h
ulz
Fix simd-tes
t
commit
|
commitdiff
|
tree
2018-08-18
Ro
l
a
nd
Schulz
readab
i
lity-
i
mplicit-bool-c
o
nversion 2/2
commit
|
commitdiff
|
tree
2018-08-18
Roland Schulz
readabili
t
y-im
p
licit-bool-conv
e
rsion 1/2
commit
|
commitdiff
|
tree
2018-08-18
R
o
land
Schul
z
clang-tidy moder
n
iz
e
commit
|
commitdiff
|
tree
2018-08-18
Roland Schu
l
z
clang-ti
d
y: g
o
ogle
t
ests applica
b
l
e
commit
|
commitdiff
|
tree
2018-08-18
Ro
l
and Schulz
Ena
b
le clang tidy/wa
r
nings for tests
commit
|
commitdiff
|
tree
2018-08-14
Rola
n
d
S
chulz
Fix int/bool bug
s
commit
|
commitdiff
|
tree
2018-08-14
Ro
l
and
S
c
hulz
Remove
B
a
s
icVec
t
or
.
a
s
_
vec
commit
|
commitdiff
|
tree
2018-08-13
Roland Schulz
Remove
c
o
d
e duplication i
n
trajana/mo
d
ules/traje
c
tor
y
commit
|
commitdiff
|
tree
2018-08-13
Roland Schulz
R
e
move cppcheck
commit
|
commitdiff
|
tree
2018-08-13
Roland Schulz
Fix M
S
D
commit
|
commitdiff
|
tree
2018-08-12
Roland
S
chulz
3/3 of
o
ld-style
casting
commit
|
commitdiff
|
tree
2018-08-12
Roland Schulz
A
dd
_real user define
d
litera
l
commit
|
commitdiff
|
tree
2018-08-11
Roland S
c
h
u
l
z
Enable c
l
ang-
t
idy for
h
eaders
commit
|
commitdiff
|
tree
2018-08-10
Roland Schulz
Avoid using gl
o
bal variables
i
n
programs
commit
|
commitdiff
|
tree
2018-08-08
Roland
S
chulz
2/3 of old-styl
e
c
a
s
t
ing
commit
|
commitdiff
|
tree
2018-08-08
Roland Schulz
Fix part
of old-styl
e
casting
commit
|
commitdiff
|
tree
2018-08-08
Rola
n
d
S
chulz
R
e
move
g
m
x
c
u
stom
fixed int (e
.
g
.
gmx_i
n
t64_t
)
types
commit
|
commitdiff
|
tree
2018-08-07
Rolan
d
Schulz
Fix clang-tidy MPI
w
arnings
commit
|
commitdiff
|
tree
2018-08-06
Rolan
d
Sc
h
u
lz
C
hange
g
m
x_bo
o
l from int to bool
commit
|
commitdiff
|
tree
2018-08-06
Roland Sch
u
lz
Disable FPE for GC
C
7
.
* with optimizations
commit
|
commitdiff
|
tree
2018-08-04
R
oland Schul
z
clan
g
-
t
idy:
m
od
e
r
nize make-
u
nique/shared
commit
|
commitdiff
|
tree
2018-07-30
Ro
l
an
d
Schulz
Dis
a
ble FPEs
at e
n
d of runner
commit
|
commitdiff
|
tree
2018-07-16
Roland Schulz
F
i
x
Windo
w
s+Intel
commit
|
commitdiff
|
tree
2018-07-16
Roland Sc
h
ulz
Warn
f
or
type mismatch for gmx
printf like functions 1/3
commit
|
commitdiff
|
tree
2018-07-16
Rol
a
nd Sch
u
lz
En
a
ble debug FP exceptio
n
s without TPI, not with T
P
I
commit
|
commitdiff
|
tree
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