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Fix gmx h2order -d option
2020-07-15
Al
e
xey Shvetsov
A
l
lo
w
to compile templat
e
with gmx-
l
agacyapi enabled
Signed-off-by:
Alexey Shvetsov
<alexxyum@gmail.com>
commit
|
commitdiff
|
tree
2018-11-05
A
le
x
ey Shvetsov
D
i
sable -Wn
o
-missing-proto
t
ypes
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2018-08-26
Ale
x
ey Shvetsov
Add basic operations for gmx::BasicVector<>
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
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tree
2017-12-05
Alexey Shvetsov
F
i
x
buil
d
with
cma
k
e 3
.
10 on
Linux
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2016-02-16
Alexey Shvetsov
Sam
e
f
ix
f
or XeonPhi (
d
o
uble precision)
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2016-02-16
Alexe
y
Shvetsov
Make
GROMACS c
o
mpile again on
XeonPhi
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2015-12-26
Alexey Shvetsov
Make
m
ol
e
culetyp
e
case sensitive
commit
|
commitdiff
|
tree
2015-09-15
Al
e
x
e
y
Shvetsov
pro
g
rams/view: move f
r
om C to C++ headers
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2015-07-16
Alexey Shvetsov
Fix build
failure
in view
/
filter
.
c
pp
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2015-06-26
A
l
exey Shve
t
sov
F
i
x
re
c
ent compilati
o
n iss
u
e in pul
l
code
commit
|
commitdiff
|
tree
2015-05-16
Alexey
Shvetsov
Make
b
ond-ato
m
type
s
case sen
s
it
i
ve
commit
|
commitdiff
|
tree
2014-05-09
A
lexey Shvetsov
Fi
x
cl
a
ng 3
.
5 w
a
rnings regarding *abs*
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2014-04-17
Alex
e
y Shvetsov
Mov
e
sfactor
.
[h
c
]
to g
m
xana
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2014-02-26
Alexey Shvetso
v
Fix -Wm
a
ybe-uninitialized w
a
rn
i
ngs
in some fi
l
es
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-11-30
Ale
x
ey Sh
v
et
s
o
v
Fix -Wstri
c
t-overflow in domdec
.
c
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
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tree
2013-10-30
A
l
e
xey
S
hv
e
tsov
grom
a
cs cpp:
clea
n
up -W
u
nused-parameter warnings
commit
|
commitdiff
|
tree
2013-10-30
Alexey Sh
v
etsov
nbnxn
_
kernels: Clean
u
p
-
Wunused-param
e
ter warnings
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-10-29
Alexe
y
Shvetsov
mdlib:
C
l
e
a
n
up -Wunused-param
e
ter warnings
commit
|
commitdiff
|
tree
2013-09-26
A
lexey Shvetsov
g_tune_pme: Clean up -Wunused-parameter war
n
i
ngs
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-09-26
Al
e
xey S
h
v
e
tsov
programs: clean up
-Wunused-
p
arameter
w
ar
n
ings
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
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tree
2013-07-25
Alexey
S
hvet
s
ov
nb_kerne
l
_
sparc64_hpc
_
ace_do
u
b
l
e: clean up
-Wunused
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alexey
Shvet
s
o
v
nb_kernel_sse4_1_d
o
ub
l
e:
c
lea
n
up
-
Wunused-parameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
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tree
2013-07-25
Alexey S
h
vetsov
nb_
k
e
r
n
e
l_sse2_double: c
l
ean
up -
W
unused-parameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alexey Shv
e
tsov
nb_
k
ernel_
a
vx_256_double: cl
e
an up -Wunu
s
ed-paramete
r
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
A
l
exey
S
hv
e
t
s
ov
nb_kernel_avx_128_fma_double: c
l
ean up -Wunused-parameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alexey
Shvetsov
nb_kern
e
l
_ss
e
2_single: clea
n
up -Wunused-parameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alexey
Shv
e
t
s
ov
nb_kernel_sse4_1
_
single
:
clean up -Wunused-parameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alexey Sh
v
etso
v
nb_ke
r
nel_avx_128_f
m
a_single: clean u
p
-
Wunuse
d
-paramet
e
r
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alexey Shvetsov
nb
_
kernel_
a
vx_256_single: clean u
p
-Wunused-p
a
rameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alex
e
y
Shvetsov
nonbo
n
de
d
a
nd nb_kernel_c: clean
u
p -Wunused-p
a
rameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-25
Alexey Shvetso
v
m
dlib: clea
n
up -Wunused-parameter
warnings
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-18
A
l
ex
e
y Shvetsov
linea
r
algebra and fft: clean up
-
W
u
nus
e
d-p
a
rameter
.
.
.
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-18
Alexey Shvetsov
gmxli
b
: cle
a
n up
-
Wunused-par
a
meter
warnings
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-14
Al
e
xey Shvetsov
gmxpreprocess: clean up -Wunu
s
ed-parameter warnings
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-14
Alexey Shvetsov
gmxana: clean
up -W
u
nused-paramete
r
warnings
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2013-07-11
Alexey
Sh
v
e
t
sov
M
a
ke unc
r
usti
f
y
.
sh compatible with more
recent env
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
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tree
2012-12-22
Alexey Shve
t
sov
[tools] g_sa
n
s - add trajectory avereging
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2012-12-07
Alexey
Shv
e
tsov
[tools] Sp
l
it off g_saxs from g_rdf
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2012-10-18
Alexey Shve
t
sov
[tools] Allow g_dist
to use de
f
ault index gr
o
u
p
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2012-10-05
Alexey Shvets
o
v
[tools] g_sans
- add trajectory avereging
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2012-05-09
A
lexey S
h
v
etsov
[tools] g_sa
n
s - add OpenMP base
d
parallelism
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2012-04-26
A
lexey Shvetsov
[tool
s
]
g_san
s
- splite
d
out fixes a
n
d added citation
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2012-03-01
A
l
exey
Shvet
s
ov
[tools] Move common functions
from g
m
x
_
sans
.
c to n
s
f
actor
.
c
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2012-01-25
Ale
x
ey Shve
t
s
ov
g_sans - tool to compute SANS spe
c
t
ra
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2011-11-08
Alexey Shvetsov
mdp
o
ptions i
n
*
.
html al
s
o use
s
'
-'
i
nstead of '_'
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2011-10-20
Alexey
S
hve
t
s
o
v
Rep
l
ace '_' to '-' in mdp options for tutor
i
als
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2011-10-20
Alexe
y
S
hv
e
tsov
Replace
'
_' in all
m
dp options to '-'
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
|
tree
2011-10-11
A
lexe
y
Shvetsov
Add
C
MakeLists
.
t
x
t
.
user to gitignore
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
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tree
2011-10-11
Alexe
y
Sh
v
etso
v
Updated gromp
p
.
mdp for
tutor/water
Signed-off-by:
Alexey Shvetsov
<alexxy@omrb.pnpi.spb.ru>
commit
|
commitdiff
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