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Clarify which of the main energy terms are printed.
2019-05-24
Artem Zhmurov
Clarify which of the main e
n
ergy terms are pr
i
nted
.
commit
|
commitdiff
|
tree
2019-05-24
Artem Zhmur
o
v
Clar
i
fy the
E
nergyOutput
I
I
I
commit
|
commitdiff
|
tree
2019-05-24
A
rtem Z
h
murov
C
l
ar
i
fy the
E
ne
r
gyOut
p
ut
I
I
commit
|
commitdiff
|
tree
2019-05-13
Artem Zhmurov
Cl
a
rify
t
he EnergyO
u
tput
I
commit
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commitdiff
|
tree
2019-05-12
Artem Zhm
u
rov
CUD
A
version of Leap-Frog
i
n
teg
r
ator with basic tests
commit
|
commitdiff
|
tree
2019-05-06
Arte
m
Zhm
u
rov
F
ixing min
o
r
m
e
m
ory
i
ssues in MDLib
commit
|
commitdiff
|
tree
2019-05-02
Ar
t
em Zhmurov
U
s
e
t
e
st wi
t
h
paramet
e
r
s for En
e
rg
y
Output
commit
|
commitdiff
|
tree
2019-04-30
Art
e
m Zhmurov
CUDA version
o
f SE
T
T
L
E alg
o
rit
h
m
w
ith
b
asi
c
tests
commit
|
commitdiff
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tree
2019-04-29
A
rtem Zhmurov
Fi
x
f
or
t
he
CUDA versio
n
o
f
L
I
NCS
commit
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commitdiff
|
tree
2019-04-28
Ar
t
em
Zhmurov
CUDA
v
ersion of L
I
NCS constr
a
ints
.
commit
|
commitdiff
|
tree
2019-04-25
Artem Zhmurov
Im
p
r
ovements for
e
n
ergy output tes
t
.
commit
|
commitdiff
|
tree
2019-04-16
Artem Zhmurov
Fix for
th
e
memory access e
r
r
o
r in con
s
traints test
.
commit
|
commitdiff
|
tree
2019-04-04
Artem
Z
hmu
r
ov
Remove isPressure
C
ouplingSte
p
(
.
.
.
)
commit
|
commitdiff
|
tree
2019-04-04
Ar
t
e
m
Z
hmurov
R
e
move isTe
m
pera
t
ureCouplingStep(
.
.
.
)
commit
|
commitdiff
|
tree
2019-03-28
Artem Zh
m
urov
GPU nam
i
ng
c
o
n
vent
i
ons
commit
|
commitdiff
|
tree
2019-03-25
Arte
m
Z
h
murov
Remo
v
e un
u
s
ed he
a
ders
commit
|
commitdiff
|
tree
2019-03-13
A
rtem Zhmu
r
o
v
B
asic rou
t
i
nes
t
o han
d
le periodic boundary
.
commit
|
commitdiff
|
tree
2019-02-21
Artem Zhmuro
v
Test
for LINCS and
S
H
A
KE co
n
straints
.
commit
|
commitdiff
|
tree
2019-02-19
Artem Zhmurov
PBC setup for G
P
U is moved into pbcu
t
ils
.
commit
|
commitdiff
|
tree
2019-02-13
Artem Zhmurov
I
g
nor
e
Visual Studio Co
d
e metad
a
ta
.
commit
|
commitdiff
|
tree
2018-12-27
Artem Zhmur
o
v
T
he tests
f
or LINCS and
S
H
A
KE constra
i
nts
.
commit
|
commitdiff
|
tree