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Removed unnecessary static declarations for command-line parsing
2017-06-30
Aleksei Iupi
n
o
v
Remov
e
outdated cmak
e
nvcc logic
commit
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commitdiff
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tree
2017-06-12
Alek
s
e
i
I
upinov
Store a
p
h
y
sic
a
l node communicat
o
r in t_commrec
commit
|
commitdiff
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tree
2017-03-17
A
leksei Iupinov
Fix dereferenc
i
ng
nullp
t
r in PME so
l
v
e
work destructo
r
commit
|
commitdiff
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tree
2017-03-03
A
l
ek
s
ei Iupinov
R
e
mo
v
e outda
t
ed CUDA
versi
o
n chec
k
commit
|
commitdiff
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tree
2017-02-21
Al
e
k
s
ei
Iu
p
inov
Remov
e
unused f
u
nction cu_s
y
nchstream_atdat()
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|
commitdiff
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tree
2017-02-09
Alekse
i
Iu
p
ino
v
Add
initializati
o
n to dvdlambda in bonded forces tests
commit
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commitdiff
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tree
2017-02-09
Aleksei Iupinov
Fix typo (Dihedarl -> D
i
hedral)
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commitdiff
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tree
2017-02-08
Aleksei
Iupinov
PME force ga
t
heri
n
g t
e
sts
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|
commitdiff
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tree
2017-02-08
Aleksei Iupinov
Fix
i
nvalid triclinic bo
x
i
n the PME
t
e
s
t
data
commit
|
commitdiff
|
tree
2017-01-24
Aleksei
Iupinov
PME spl
i
ne comp
u
tat
i
on and charge spreading tests
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|
commitdiff
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tree
2017-01-24
Aleksei Iupinov
Add cons
t
qualifier to some PME spread arguments
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|
commitdiff
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tree
2017-01-19
Ale
k
s
ei Iupinov
Simpli
f
y gmx_coun
t
_gpu
_
de
v
_
u
niq
u
e()
commit
|
commitdiff
|
tree
2017-01-19
Ale
k
s
ei Iupinov
P
ME B-Spline moduli computati
o
n unit
test
commit
|
commitdiff
|
tree
2017-01-05
A
l
e
k
sei Iupinov
Fix compilat
i
on with
CMA
K
E_
C
XX_FLAGS="
-
Wal
l
-We
r
ror"
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commitdiff
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tree
2016-12-22
Aleksei
Iupin
o
v
R
emove unused m
e
mber th
r
ead_one
fr
o
m the PME
splin
e
.
.
.
commit
|
commitdiff
|
tree
2016-12-05
Aleksei
I
upi
n
ov
Stop
including parallel_3df
f
t
.
h in h
e
aders
commit
|
commitdiff
|
tree
2016-12-01
A
lekse
i
Iupinov
Move
G
PU a
s
signment functions into a se
p
arate
f
ile
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|
commitdiff
|
tree
2016-11-21
A
l
ek
s
ei Iupin
o
v
Move ha
r
dco
d
ed
P
M
E grid index
i
ng constants
in
t
o
h
e
ader
commit
|
commitdiff
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tree
2016-11-01
Aleksei Iupi
n
ov
Remove imatrix type and related
u
n
u
sed/e
r
roneous code
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tree
2016-10-24
A
l
e
k
sei Iu
p
inov
Trea
t
CUDA files as C++ during cppcheck
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|
commitdiff
|
tree
2016-10-10
Aleksei Iu
p
inov
Fix
triv
i
a
l PM
E
me
m
ory le
a
ks
commit
|
commitdiff
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tree
2016-09-15
Aleksei Iupinov
Mov
e
the PME
Ewald coeffic
i
ents
t
o the P
M
E structure
commit
|
commitdiff
|
tree
2016-09-10
Al
e
k
sei
Iu
p
inov
F
i
x PME da
t
a destr
u
c
tor n
o
t being called
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tree