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Bug fix: Constraints tests are not instantiated with CUDA
2019-06-18
Artem
Z
hmurov
B
u
g
fix: Constraints tes
t
s
a
r
e not
instantiate
d
with
.
.
.
commit
|
commitdiff
|
tree
2019-05-24
Artem Zhmurov
Clari
f
y
which of the mai
n
e
n
e
rgy
terms are p
r
in
t
ed
.
commit
|
commitdiff
|
tree
2019-05-24
A
r
tem Zhmurov
Clarify
t
he Energ
y
Output III
commit
|
commitdiff
|
tree
2019-05-24
Artem Zhmu
r
ov
Cl
a
rify the Ene
r
gyOutput II
commit
|
commitdiff
|
tree
2019-05-13
Artem
Zhmurov
Clarif
y
the EnergyOutput I
commit
|
commitdiff
|
tree
2019-05-12
Art
e
m
Z
h
murov
CUDA vers
i
on of L
e
a
p
-
Fro
g
inte
g
rator with basic
te
s
t
s
commit
|
commitdiff
|
tree
2019-05-06
A
r
tem Zhmurov
F
ixing min
o
r memory issu
e
s
in MDLib
commit
|
commitdiff
|
tree
2019-05-02
Artem Zhmurov
Use test with parameters for EnergyOutpu
t
commit
|
commitdiff
|
tree
2019-04-30
Artem
Zhmu
r
o
v
CUDA ve
r
sion of SETTLE al
g
orithm wi
t
h basic tests
commit
|
commitdiff
|
tree
2019-04-29
Artem Zh
m
u
r
o
v
F
i
x for
the CU
D
A version
o
f
LIN
C
S
commit
|
commitdiff
|
tree
2019-04-28
Artem
Z
hmuro
v
C
U
DA version of
LINCS co
n
straints
.
commit
|
commitdiff
|
tree
2019-04-25
Artem Zhmurov
I
m
provements for energy out
p
ut t
e
st
.
commit
|
commitdiff
|
tree
2019-04-16
Arte
m
Z
hmurov
Fix fo
r
the me
m
or
y
access err
o
r in constra
i
nt
s
test
.
commit
|
commitdiff
|
tree
2019-04-04
A
rtem Zhmurov
Remov
e
isPressureCouplingStep(
.
.
.
)
commit
|
commitdiff
|
tree
2019-04-04
Artem Zhmurov
Rem
o
ve isTemperat
u
reCouplingStep
(
.
.
.
)
commit
|
commitdiff
|
tree
2019-03-28
A
rtem Zhm
u
r
o
v
GPU naming con
v
ention
s
commit
|
commitdiff
|
tree
2019-03-25
A
rtem Zhmurov
Remove u
n
used he
a
ders
commit
|
commitdiff
|
tree
2019-03-13
A
rtem
Zhmurov
Basic routines
t
o hand
l
e
periodic b
o
undary
.
commit
|
commitdiff
|
tree
2019-02-21
A
r
t
em Z
h
murov
Test
f
o
r LINCS and SH
A
KE constraints
.
commit
|
commitdiff
|
tree
2019-02-19
Art
e
m Zh
m
urov
PBC se
t
up
f
or GPU is mo
v
ed
i
n
t
o
pbc
u
tils
.
commit
|
commitdiff
|
tree
2019-02-13
Art
e
m Z
h
muro
v
Ignore Visual Studi
o
Code metadata
.
commit
|
commitdiff
|
tree
2018-12-27
Ar
t
e
m
Zh
m
u
rov
The t
e
s
t
s
for
LINCS
and SHAKE constraints
.
commit
|
commitdiff
|
tree
