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Clean up thread teardown
2019-01-09
Kevin Bo
y
d
Clean
u
p
thread t
e
ard
o
wn
commit
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commitdiff
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tree
2019-01-09
K
e
v
in Boyd
Clean up PME load balancing struct
commit
|
commitdiff
|
tree
2019-01-07
Kevin Bo
y
d
Clean u
p
ekind str
u
c
t
commit
|
commitdiff
|
tree
2019-01-06
Kevin Boyd
Conv
e
rt t
_
vcm to C++, pluggi
n
g a memory leak
commit
|
commitdiff
|
tree
2019-01-02
Kevin Boyd
Free to
p
olo
g
y in non-DD simulatio
n
s
commit
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commitdiff
|
tree
2018-12-31
Ke
v
in Boy
d
Only report
intra
-
sim communication with mu
l
tiple
r
anks
commit
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commitdiff
|
tree
2018-12-31
Kevin Boyd
Free
m
ore memory
i
n c
o
nstraints cleanup
commit
|
commitdiff
|
tree
2018-12-28
Kevin B
o
yd
Change t_
e
xtmass pointers to std::vector
commit
|
commitdiff
|
tree
2018-12-28
Kevin Boyd
Convert g
m
x_st
o
c
h
d
_
t to C++
commit
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commitdiff
|
tree
2018-12-27
K
e
vin
B
o
yd
U
se
s
td::v
e
ctor f
o
r trotter_seq
commit
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commitdiff
|
tree
2018-12-27
Kevin Boyd
M
a
ke all thread-mpi threads rel
e
as
e
cr s
t
ructure
commit
|
commitdiff
|
tree
2018-12-27
Kevi
n
Boyd
Remove unus
e
d function decla
r
ations in update
.
h
commit
|
commitdiff
|
tree
2018-12-26
Kevin
Bo
y
d
F
ix small
leaks in do_md
c
leanup
commit
|
commitdiff
|
tree
2018-12-21
Kevin Boyd
F
r
ee g
l
ob
a
l_stat at end of do_md
commit
|
commitdiff
|
tree
2018-12-21
Kev
i
n Boy
d
C
all wallcy
c
le
c
ounter cleanup
function
commit
|
commitdiff
|
tree
2018-12-21
K
e
v
in Boyd
Fix leak
i
n
l
egacymdrunoptions
commit
|
commitdiff
|
tree
2018-12-21
Kevin Boyd
Fix small leak in forcerec
commit
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commitdiff
|
tree
2018-12-17
K
e
vin Boyd
F
ix memory lea
k
s in ns
cleanup
commit
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commitdiff
|
tree
2018-12-17
Kevin Bo
y
d
F
i
x memory
l
e
a
k at end o
f
do_md
commit
|
commitdiff
|
tree
2018-11-11
K
e
v
i
n Boyd
Add
t
e
sting
utilit
y
for in
-
place
m
odification of input
.
.
.
commit
|
commitdiff
|
tree
2018-10-29
Kevin Boyd
Add const
r
uctor
f
o
r t_corr in gmx_msd
commit
|
commitdiff
|
tree
2018-09-27
Ke
v
in Bo
y
d
Reduce
pre
p
rocessor de
p
e
n
dency
in
resourced
i
vision
.
cpp
commit
|
commitdiff
|
tree
2018-09-17
K
evi
n
Bo
y
d
Added basic tests
f
o
r
gmx msd
commit
|
commitdiff
|
tree
2018-09-03
Ke
v
in
B
oyd
Co
r
rect
i
nfo
in B
e
rendsen p-coupli
n
g mdp optio
n
commit
|
commitdiff
|
tree
2018-09-02
Kevin Bo
y
d
Fixed bug
r
eporting initial DLB
st
a
te
commit
|
commitdiff
|
tree
2018-08-10
K
e
v
in Boyd
Add
e
d
p
h
y
s
ic
a
l val
i
da
t
i
o
n
document to the
d
ev manual
.
commit
|
commitdiff
|
tree
2018-08-06
Kevin Boyd
Fix gmx solvate topology updating
commit
|
commitdiff
|
tree
2018-08-04
Kevin
Boyd
Support hwl
o
c 2
.
x
.
x
commit
|
commitdiff
|
tree
2018-07-31
Kev
i
n Bo
y
d
R
e
port up to date hwlo
c
version in
f
ormation
commit
|
commitdiff
|
tree
2018-07-29
K
e
vin Boyd
Fixed synta
x
e
rror
i
n make_g
r
omos_rtp
.
py
commit
|
commitdiff
|
tree
2018-06-14
Kevin Boyd
C
h
a
nged documentation on
c
ommon errors duri
n
g
m
i
nim
i
zat
i
on
commit
|
commitdiff
|
tree
2018-06-06
Kevin Bo
y
d
Added t
o
PME on
GPU information
in mdru
n
performa
n
ce
commit
|
commitdiff
|
tree
2018-06-01
Kevin Boyd
Cosm
e
tic fixes to mdp documentatio
n
commit
|
commitdiff
|
tree
2018-05-23
Kevin Boyd
R
e
moved "XXX
n
o
n
-m
a
t
c
hing atom n
a
m
es" Martini statement
.
commit
|
commitdiff
|
tree
2018-05-22
Kevin Boy
d
Cosmetic documentation change
s
commit
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commitdiff
|
tree
2018-05-22
Kevin Boyd
Mi
n
or fixes t
o
m
d
r
un perform
a
nc
e
documentation
commit
|
commitdiff
|
tree