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Version bumps after new release
2015-05-13
M
ark
A
braha
m
V
e
rsion bum
p
s
a
fter new release
commit
|
commitdiff
|
tree
2015-05-13
M
a
rk
A
brah
a
m
Vers
i
on 5
.
0
.
5
commit
|
commitdiff
|
tree
2015-05-12
Rossen Apost
o
l
o
v
Added
a note about sc-coul being auto turne
d
o
n
.
commit
|
commitdiff
|
tree
2015-05-05
Mar
k
Abraham
M
e
rge release-4
-
6 into
rel
e
as
e
-5-0
commit
|
commitdiff
|
tree
2015-03-19
Mark Abraham
Made
error m
e
ssage mo
r
e generic
commit
|
commitdiff
|
tree
2015-02-24
Ake Sandgr
e
n
T
he test for HAVE_CXX11_REGEX f
a
ils si
n
ce it d
o
e
sn
.
.
.
commit
|
commitdiff
|
tree
2015-02-24
Ake Sandgren
Checks should use corre
c
t CMAKE_RE
Q
UIRED_ variables
commit
|
commitdiff
|
tree
2015-02-02
Mark Abr
a
h
am
Avoid
n
ea
r
-silent g
e
neration of ze
r
o ener
g
i
e
s
commit
|
commitdiff
|
tree
2015-01-23
Mark Abraha
m
Update Fi
n
dCUDA work-arou
n
d
commit
|
commitdiff
|
tree
2015-01-08
Mark
A
braham
H
and
l
e iv
e
c
*
correctly in DD
e
rror message
commit
|
commitdiff
|
tree
2014-12-15
Mark
A
brah
a
m
Version bumps after new release
commit
|
commitdiff
|
tree
2014-12-15
Mark Abra
h
am
Version 5
.
0
.
4
commit
|
commitdiff
|
tree
2014-12-11
M
ark Abraham
Merge re
l
ease-4-6 into release-5-0
commit
|
commitdiff
|
tree
2014-12-09
Mark Abraham
V
e
rs
i
on
b
umps after new rele
a
se
commit
|
commitdiff
|
tree
2014-12-09
Mark Abraham
Version 5
.
0
.
3
commit
|
commitdiff
|
tree
2014-11-27
Mar
k
Abraha
m
Merge branch
r
e
lea
s
e-4-6 into release-5-0
commit
|
commitdiff
|
tree
2014-11-24
Berk
H
ess
Avoid Na
N
in rlis
t
buf
f
er ca
l
culation
commit
|
commitdiff
|
tree
2014-10-17
Mark Abraha
m
Ex
t
end gmo
c
k to turn off
s
ocket listener
commit
|
commitdiff
|
tree
2014-10-13
Mark Abraham
Merge rele
a
se-4-6 into re
l
e
a
se-5-0
commit
|
commitdiff
|
tree
2014-10-06
Mark
A
braham
Fix
t
rjconv -split not clo
s
i
n
g files
commit
|
commitdiff
|
tree
2014-10-01
Mark Abra
h
am
Vers
i
on
bumps af
t
e
r new release
commit
|
commitdiff
|
tree
2014-10-01
Mark Abraham
Ve
r
sion
5
.
0
.
2
commit
|
commitdiff
|
tree
2014-10-01
Carsten Kutzner
Allow gmx tune_pme to sk
i
p the chec
k
f
o
r comma
n
d-
l
ine
.
.
.
commit
|
commitdiff
|
tree
2014-09-18
Mark Ab
r
aham
Merge
b
r
anch rel
e
ase-4
-
6
into r
e
l
ease-5-
0
commit
|
commitdiff
|
tree
2014-09-11
Mar
k
Abraham
R
emo
v
e
d
ocumentation references to o
p
timize-fft
commit
|
commitdiff
|
tree
2014-09-05
Mar
k
Abraha
m
V
ersion
bumps af
t
er
new rel
e
ase
commit
|
commitdiff
|
tree
2014-09-05
Mark Abraha
m
Ver
s
ion
5
.
0
.
1
commit
|
commitdiff
|
tree
2014-09-01
M
ark Abraham
Merg
e
b
r
a
nch rele
a
se-4-6 i
n
t
o release-
5
-0
commit
|
commitdiff
|
tree
2014-08-29
Mark Abraham
V
e
rsio
n
bump after 4
.
6
.
7
commit
|
commitdiff
|
tree
2014-08-23
Te
e
mu Murtola
Ba
c
kpor
t
of 'Remove unu
s
ed fig
u
res from share
/
html/
'
commit
|
commitdiff
|
tree
2014-07-07
Mark Abraham
Version bump after 4
.
6
.
6 releas
e
commit
|
commitdiff
|
tree
2014-06-29
Mark Abra
h
a
m
Ver
s
ion
bump for 5
.
0
commit
|
commitdiff
|
tree
2014-06-29
Mark Abr
a
h
am
Add forgot
t
en l
i
cens
e
s to COPY
I
NG
commit
|
commitdiff
|
tree
2014-06-28
Mark
Abraham
Merge branch 'relea
s
e-4-6'
i
n
t
o
rele
a
se
-
5-0
commit
|
commitdiff
|
tree
2014-06-26
Roland Schulz
Merg
e
relea
s
e-4-6 int
o
releas
e
-5-0
commit
|
commitdiff
|
tree
2014-06-24
Berk
H
es
s
Fixed th
e
sign of mass
perturbed contr
i
buti
o
n
commit
|
commitdiff
|
tree
2014-06-17
E
r
ik Lindahl
Disab
l
ed
replica exchan
g
e
w
he
n
T n
o
t in or
d
er
commit
|
commitdiff
|
tree
2014-06-05
Berk
H
ess
Fi
x
ed shi
f
t and sw
i
tch modifiers,
p
articularly fo
r
.
.
.
commit
|
commitdiff
|
tree
2014-06-02
Erik Lindahl
Added gr
o
mpp che
c
k
s
f
o
r zero
a
to
m
masses i
n
stat
e
B
commit
|
commitdiff
|
tree
2014-06-01
Eri
k
Lindahl
Two quotes contributed by V
e
d
r
an Milet
i
c
commit
|
commitdiff
|
tree
2014-05-27
Rol
a
n
d
S
chulz
Merge releas
e
-4-
6
i
n
t
o
rel
e
a
s
e
-5-
0
commit
|
commitdiff
|
tree
2014-05-20
Ma
r
k
Abraham
Fi
x
co
p
y
righ
t
years for new code
commit
|
commitdiff
|
tree
2014-05-13
M
ark Abraha
m
Prohibit AVX_256
wit
h
buggy gcc 4
.
6
.
1
commit
|
commitdiff
|
tree
2014-04-29
Mark Abraham
M
e
rge branch release-4-6 into r
e
lease-5-0
commit
|
commitdiff
|
tree
2014-04-10
Mark Abra
h
am
M
erge br
a
nc
h
'
r
eleas
e
-4-6' i
n
t
o relea
s
e-5-0
commit
|
commitdiff
|
tree
2014-04-07
Mark
Abr
a
ham
V
e
rsion b
u
mp for 5
.
0-rc1
commit
|
commitdiff
|
tree
2014-03-31
Te
e
mu
M
u
rt
o
la
Remove #include
<
.
.
.
> for
local
files
i
n
g
mx-
v
iew
commit
|
commitdiff
|
tree
2014-03-26
Mark Abraham
Fix use of inline in IMD
commit
|
commitdiff
|
tree
2014-03-23
Mark
Abraham
Merge branch release
-
4-6
commit
|
commitdiff
|
tree
2014-03-18
Mark Abraham
Revert "Added ne
w
amber
9
9sb-ildn-bs
c
0 force fiel
d
.
"
commit
|
commitdiff
|
tree
2014-03-17
Mark Abraham
H
o
use-keeping for MTTK
commit
|
commitdiff
|
tree
2014-03-17
Mark A
b
raham
M
e
rge bra
n
ch rele
a
se
-
4-6
commit
|
commitdiff
|
tree
2014-03-11
R
o
s
sen Aposto
l
ov
Remove
d
.
itp fi
l
es
f
rom top level
directory
.
commit
|
commitdiff
|
tree
2014-03-06
Mark
Abra
h
am
Fix
formatting
i
n in
s
t
al
l
g
u
ide
commit
|
commitdiff
|
tree
2014-03-06
M
ark
A
braham
Fix CMake synta
x
er
r
or
commit
|
commitdiff
|
tree
2014-03-03
Mark Abraham
F
i
x ca
l
l
i
ng
SIMD grou
p
kernel
s
commit
|
commitdiff
|
tree
2014-02-26
R
olan
d
Schulz
Use
redu
c
e in pme
commit
|
commitdiff
|
tree
2014-02-26
Eri
k
L
indahl
Redesigned SIMD module and
uni
t
tes
t
s
.
commit
|
commitdiff
|
tree
2014-02-24
Berk H
e
s
s
I
m
plem
e
nted
L
J
-PME nbn
x
n
kernels
commit
|
commitdiff
|
tree
2014-02-21
Szilard Pa
l
l
portabil
i
ty aspe
c
ts i
n
install
gu
i
d
e
+
m
inor t
w
e
aks
commit
|
commitdiff
|
tree
2014-02-19
B
e
rk Hess
Impl
e
me
n
ted nbn
x
n LJ swi
t
ch funct
i
ons
commit
|
commitdiff
|
tree
2014-02-18
M
ark Abraham
F
ix
outstanding references to "CPU a
c
c
eleration"
commit
|
commitdiff
|
tree
2014-02-18
M
a
rk Abraham
Extend
Te
s
tFileManager
commit
|
commitdiff
|
tree
2014-02-16
Mark
A
b
raham
Fix te
s
t refer
e
nce data a
c
cid
e
ntal
l
y b
r
oken
commit
|
commitdiff
|
tree
2014-02-11
Mark Ab
r
aham
Update st
u
f
f for
o
ld B
l
ueGene
commit
|
commitdiff
|
tree
2014-02-09
Teemu M
u
rtola
Make 'gmx
-
h' inva
r
iant w
r
t
.
p
r
ovided opt
i
o
n
s
commit
|
commitdiff
|
tree
2014-02-09
T
e
emu Mur
t
ola
Remove old he
l
p
f
o
rmatting
c
ode
commit
|
commitdiff
|
tree
2014-02-09
Teemu Murt
o
la
Make Fi
l
eNameOption behave more like o
l
d filenm p
a
r
s
er
commit
|
commitdiff
|
tree
2014-02-09
Teemu
M
urtola
Imple
m
ent synopsis for
help outp
u
t
commit
|
commitdiff
|
tree
2014-02-04
Mark
Abraham
Us
e
featur
e
to expla
i
n
t
h
at tpbconv
has
move
d
commit
|
commitdiff
|
tree
2014-02-01
Er
i
k Lindah
l
Ad
d
e
d AVX2 det
e
ction to cmak
e
and created CPU
acceleration
.
.
.
commit
|
commitdiff
|
tree
2014-01-29
M
ark
A
b
r
aham
Ke
e
p
c
la
n
g A
d
d
ress Sanitizer happy
commit
|
commitdiff
|
tree
2014-01-28
Mark
Abraham
Merge
b
ran
c
h
'
release-4
-
6'
commit
|
commitdiff
|
tree
2014-01-28
Mark Abraham
Remove unused fplog
commit
|
commitdiff
|
tree
2014-01-27
M
a
r
k
Abraham
Do
n
't n
u
mber a list manual
l
y
commit
|
commitdiff
|
tree
2014-01-21
Mark Abraham
Remov
e
hidden option to gmx
d
ump
commit
|
commitdiff
|
tree
2014-01-20
Mark Abra
h
am
Remove various
o
utdated things from the repo
commit
|
commitdiff
|
tree
2014-01-20
Mark
Abra
h
a
m
R
e
name 'gmx
t
pbcon
v
' to 'g
m
x
convert-
t
pr'
commit
|
commitdiff
|
tree
2014-01-20
Magnus Lun
d
borg
A
dd
T
NG writin
g
a
nd reading support
commit
|
commitdiff
|
tree
2014-01-09
Rolan
d
Schulz
Remo
v
e remai
n
ing usage of SIZEOF*
commit
|
commitdiff
|
tree
2014-01-08
Mark Abraham
Create math module
commit
|
commitdiff
|
tree
2013-12-05
M
ark Abraham
Ver
s
ion bump a
f
te
r
5
.
0
-
beta1
release
commit
|
commitdiff
|
tree
2013-12-05
M
a
rk Abraham
Fi
x
administ
r
ivia
commit
|
commitdiff
|
tree
2013-12-02
Mark Abra
h
a
m
Version bu
m
p after 4
.
6
.
5 release
commit
|
commitdiff
|
tree
2013-12-02
Berk He
s
s
Made cutoff-scheme=Verlet the def
a
ult
commit
|
commitdiff
|
tree
2013-12-02
Berk
Hess
Rena
m
ed
v
erle
t
-b
u
ffer-
d
rift
to ve
r
let-buf
f
er-tolerance
commit
|
commitdiff
|
tree
2013-12-02
Mark Abraham
V
e
rsion bumps bef
o
r
e re
l
ease
commit
|
commitdiff
|
tree
2013-12-02
Mark Abraham
Merge branch 'release-4-6'
commit
|
commitdiff
|
tree
2013-11-28
Teemu Murtola
Fix some #include problems
.
commit
|
commitdiff
|
tree
2013-11-27
M
a
r
k
Abraham
Fix stran
g
e character in manual
commit
|
commitdiff
|
tree
2013-11-26
Berk Hess
Fixed
r
e
t
urn v
a
lue
of gmx_mtop_bo
n
deds_free_energy
commit
|
commitdiff
|
tree
2013-11-19
Mark Ab
r
a
ham
Fix
i
n
c
orr
e
ct variable na
m
e i
n
docum
e
ntation
commit
|
commitdiff
|
tree
2013-11-15
Mark Ab
r
a
h
am
Merge
b
r
a
n
ch releas
e
-4-6
commit
|
commitdiff
|
tree
2013-11-13
Mark Abraham
B
u
m
p
versio
n
a
fter 4
.
6
.
4 release
commit
|
commitdiff
|
tree
2013-11-08
Mark
A
b
r
aham
F
ix mal
f
ormed
CMake
commit
|
commitdiff
|
tree
2013-10-26
Roland Sc
h
ulz
Fix
NBN
x
N
SIMD re
f
er
e
n
c
e
ke
r
nels
commit
|
commitdiff
|
tree
2013-10-26
Mark Abraham
Encapsulate gmx_wallcloc
k
_accounting_t into new timing
.
.
.
commit
|
commitdiff
|
tree
2013-10-23
Mark Abraham
Merge branch releas
e
-
4-
6
in
t
o master
commit
|
commitdiff
|
tree
2013-10-20
Mark Abraham
R
em
o
ve h
t
m
l
tar
g
et from and e
x
cessive PD
F
s
f
o
r ma
n
ual
commit
|
commitdiff
|
tree
2013-10-14
Szilard Pall
u
s
e CUDA texture ob
j
e
c
ts
w
h
en support
e
d
commit
|
commitdiff
|
tree
next