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Fix dereferencing nullptr in PME solve work destructor
2017-03-17
Aleksei Iupinov
Fix deref
e
rencing nullptr in PME sol
v
e work d
e
struc
t
or
commit
|
commitdiff
|
tree
2017-03-03
Aleksei Iupinov
R
emove outdated CU
D
A versi
o
n check
commit
|
commitdiff
|
tree
2017-02-21
Al
e
k
sei
I
up
i
no
v
R
e
move unused function c
u
_sync
h
s
t
ream_atd
a
t()
commit
|
commitdiff
|
tree
2017-02-09
Alek
s
ei
I
upinov
Add initialization to dvdlambda in bonded f
o
rces
t
ests
commit
|
commitdiff
|
tree
2017-02-09
Al
e
ksei
I
upinov
Fix t
y
po (Dihe
d
a
rl -> Dihedral
)
commit
|
commitdiff
|
tree
2017-02-08
Alek
s
ei Iupinov
PME fo
r
ce gat
h
ering tests
commit
|
commitdiff
|
tree
2017-02-08
Aleksei Iu
p
inov
Fi
x
i
nvalid triclinic box in the
PME te
s
t data
commit
|
commitdiff
|
tree
2017-01-24
Aleks
e
i I
u
pinov
PME
s
pline
c
omputatio
n
and charge spreading tests
commit
|
commitdiff
|
tree
2017-01-24
Aleksei Iupinov
A
dd c
o
nst qualifier to some PME spread ar
g
ument
s
commit
|
commitdiff
|
tree
2017-01-19
A
l
e
k
sei
I
u
p
i
n
ov
Si
m
p
l
i
fy
g
mx_count_gpu_de
v
_unique()
commit
|
commitdiff
|
tree
2017-01-19
Alek
s
ei Iupinov
PME B-Spline moduli comput
a
tion unit t
e
st
commit
|
commitdiff
|
tree
2017-01-05
Alek
s
ei Iup
i
n
o
v
Fix compilation with
C
MAKE_CXX_FLAGS="-Wall -
W
error"
commit
|
commitdiff
|
tree
2016-12-22
Aleksei Iupino
v
Remove unused mem
b
er
thread_one fr
o
m
the PME
s
p
l
i
n
e
.
.
.
commit
|
commitdiff
|
tree
2016-12-05
Ale
k
sei Iupinov
Stop including
parall
e
l_3dfft
.
h in
he
a
de
r
s
commit
|
commitdiff
|
tree
2016-12-01
Aleksei Iu
p
ino
v
Move GPU assignment functions into a
s
eparat
e
file
commit
|
commitdiff
|
tree
2016-11-21
Ale
k
sei
Iupi
n
ov
Move hardcoded PME grid
inde
x
ing
c
onstan
t
s int
o
h
ead
e
r
commit
|
commitdiff
|
tree
2016-11-01
Aleksei Iupinov
Re
m
ove imat
r
ix t
y
pe an
d
r
e
lated unused/erroneo
u
s cod
e
commit
|
commitdiff
|
tree
2016-10-24
Aleksei Iupinov
Treat CUDA files as C++ du
r
ing
cppcheck
commit
|
commitdiff
|
tree
2016-10-10
Aleksei
Iupinov
F
i
x trivial PME memor
y
leaks
commit
|
commitdiff
|
tree
2016-09-15
Aleksei Iup
i
nov
M
o
v
e the
P
ME Ewald
coefficients to the P
M
E s
t
ructu
r
e
commit
|
commitdiff
|
tree
2016-09-10
Alek
s
e
i
Iupinov
Fix PME data destructor not being
c
alled
commit
|
commitdiff
|
tree