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Update rules for release-2021.
2020-11-17
Joe Jordan
R
e
move some extra
n
eous comp
i
ler fla
g
s
f
r
om nbl
i
b
commit
|
commitdiff
|
tree
2020-11-09
Joe Jordan
Add backend for
n
b
lib listed for
c
e
s API
commit
|
commitdiff
|
tree
2020-11-04
Joe Jordan
NBL
I
B listed f
o
r
c
es API
upd
a
te
commit
|
commitdiff
|
tree
2020-11-02
ej
j
ordan
Upda
t
e to nbl
i
b
non-bonded bac
k
end
commit
|
commitdiff
|
tree
2020-10-30
Joe Jorda
n
In
t
roduce nbl
i
b versioning
commit
|
commitdiff
|
tree
2020-10-13
Joe Jordan
Fix segfault in p
u
ll reading
commit
|
commitdiff
|
tree
2020-10-02
Joe Jo
r
dan
Add
t
es
t
s f
o
r setStringEntry
commit
|
commitdiff
|
tree
2020-09-30
Joe
J
or
d
an
A
dd n
b
lib sampl
e
s
cript
commit
|
commitdiff
|
tree
2020-09-29
ejjordan
Fail
grac
e
fully
w
h
e
n nblib cannot b
e
built
commit
|
commitdiff
|
tree
2020-09-29
Jo
e
Jordan
Add nbli
b
ba
c
kend: Part 2 of 2
commit
|
commitdiff
|
tree
2020-09-28
Joe Jordan
Add nbl
i
b backend: Part 1 of 2
commit
|
commitdiff
|
tree
2020-09-28
Joe Jordan
Add
i
nitial nblib public
A
PI
commit
|
commitdiff
|
tree
2020-09-11
ejjorda
n
Move src/api cmake lo
g
ic into src/api cmake
file
commit
|
commitdiff
|
tree
2020-09-10
Joe Jordan
Replace GMX_ASS
E
RT
w
it
h
assert in
v
e
ctyp
e
s
.
h
commit
|
commitdiff
|
tree
2020-07-03
J
oe Jordan
Use
v
ect
o
r in atoms2md instead of point
e
r
commit
|
commitdiff
|
tree
2020-06-26
ejjordan
Increase B
D
u
l
p t
o
l
erance to avoid spurious
t
e
st fail
u
re
s
commit
|
commitdiff
|
tree
2020-06-26
ejjordan
Completely encapsulate membed
l
o
gic in MembedHolder
commit
|
commitdiff
|
tree
2020-06-26
ejjordan
Add MembedHolder
f
or SimulatorBuilder
.
commit
|
commitdiff
|
tree
2020-06-23
Joe Jordan
Remove
s
o
m
e he
a
d
ers from i
n
s
t
all targe
t
s
commit
|
commitdiff
|
tree
2020-04-30
ejjordan
Add EOF newlines to
eliminate compiler warnings
commit
|
commitdiff
|
tree
2020-04-30
e
j
j
ordan
Remove cm
a
k
e
l
ogic that is outdated by requiring cma
k
e
.
.
.
commit
|
commitdiff
|
tree
2020-04-28
ejjordan
Address
r
e
view comments
commit
|
commitdiff
|
tree
2020-04-28
ej
j
ordan
Simplif
y
cal
c
_listed signature
commit
|
commitdiff
|
tree
2020-04-28
ejjordan
F
i
x i
s
sues with che
c
k-s
o
urce
commit
|
commitdiff
|
tree
2020-02-23
ejjordan
Use mo
r
e forward declar
a
t
ions to remo
v
e
d
h
e
a
d
er dependencies
commit
|
commitdiff
|
tree
2019-12-19
ejj
o
rdan
Change so
m
e domdec data
m
emb
e
rs to RVec or I
V
ec
commit
|
commitdiff
|
tree
2019-11-15
ejjord
a
n
Fuse two adja
c
e
nt neighbor sea
r
ch branches in do_force
commit
|
commitdiff
|
tree
2019-11-14
e
j
j
ordan
R
e
m
ove qm dependence on fo
r
cerec in do_f
o
r
c
e
_
lowlevel
commit
|
commitdiff
|
tree
2019-11-14
ejj
o
rdan
Remove
u
seGp
u
Nonbonded from l
a
unc
h
GpuEndOfStepTasks
.
.
.
commit
|
commitdiff
|
tree
2019-11-13
ejjordan
Create clang-tidy cmake op
t
ion
commit
|
commitdiff
|
tree
2019-11-12
ejjorda
n
Fix typ
e
in
c
l
a
ng-for
m
at
.
sh h
e
lp text
commit
|
commitdiff
|
tree
2019-11-09
ejjo
r
dan
Fix m
d
p
parameter handling in mdrun tests
commit
|
commitdiff
|
tree
2019-11-09
ejjorda
n
Fix mdp para
m
eter
handling in mdrun tests
commit
|
commitdiff
|
tree
2019-11-08
ejjordan
F
i
x 2 broken
NO
L
IN
T
's f
r
om
cl
a
n
g
-
f
ormat change
commit
|
commitdiff
|
tree
2019-11-08
e
j
jordan
Fix 2 b
r
oken NOLINT's from cl
a
n
g
-
f
or
m
at
c
hange
commit
|
commitdiff
|
tree
2019-10-23
ejjordan
M
ake t_
n
extnb a
n
imp
l
ementation
detail
commit
|
commitdiff
|
tree
2019-10-22
ejjordan
Remove unused functions fr
o
m g
m
xpreprocess
commit
|
commitdiff
|
tree
2019-10-22
ejjo
r
d
an
R
emov
e
u
n
u
sed fu
n
ction gen
e
r
a
t
e_excls and m
a
k
e
c
le
a
n_exc
l
s
.
.
.
commit
|
commitdiff
|
tree
2019-09-19
ejjor
d
a
n
Remove or u
p
d
ate
comments containing 'group s
c
heme'
commit
|
commitdiff
|
tree
2019-09-16
ejjordan
A
d
d
some coo
l
quotes
commit
|
commitdiff
|
tree
2019-04-16
ejjordan
D
ie
with helpful note in case of
i
ncorr
e
ct input to
.
.
.
commit
|
commitdiff
|
tree
2019-04-15
ejjo
r
dan
fix formatt
i
ng of editc
o
nf note
commit
|
commitdiff
|
tree