repo.or.cz
/
gromacs
/
qmmm-gamess-us.git
/
search
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
log
|
graphiclog1
|
graphiclog2
|
commit
|
commitdiff
|
tree
|
refs
|
edit
|
fork
first
·
prev
·
next
minor fixes in ditribution files
2010-05-31
Szilard Pall
m
i
nor f
i
xes
in ditribu
t
ion files
commit
|
commitdiff
|
tree
2010-05-31
Szilard P
a
ll
Merge br
a
nch 'master'
o
f git@gi
t
.
gr
o
mac
s
.
org:gr
o
macs
commit
|
commitdiff
|
tree
2010-05-31
Szilard Pall
Upda
t
ed R
E
AD
M
E
a
nd INSTA
L
L file
s
,
adde
d
RE
A
DM
E
-GPU
.
.
.
commit
|
commitdiff
|
tree
2010-05-31
Szilar
d
P
a
ll
Fixed
t
ypo in CMak
e
Lists for mdrun-
g
pu
commit
|
commitdiff
|
tree
2010-05-30
Szilard Pall
O
p
enM
M
: ad
d
ed
combination rule check, disa
b
led re
s
tra
i
n
t
.
.
.
commit
|
commitdiff
|
tree
2010-05-30
S
zilar
d
P
all
Fix for MSVC linking
a
nd r
e
lea
s
e-bui
l
d Op
e
nMM plugin
.
.
.
commit
|
commitdiff
|
tree
2010-05-26
Szilard Pall
Fixed some
compiler warini
g
s,
minor bugs and documentation
.
.
.
commit
|
commitdiff
|
tree
2010-05-19
Szilard
Pall
Merge branc
h
'
ma
s
ter' o
f
git@
g
it
.
gromacs
.
org
:
g
rom
a
cs
commit
|
commitdiff
|
tree
2010-05-19
Szilard Pall
fixed the PME toleran
c
e "adjustmen
t
"
for OpenMM
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
Merge branch 'master' of git@gi
t
.
g
rom
a
cs
.
org:g
r
omacs
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
Fix in
o
penmm_wrapper
wh
i
ch makes it work with MS
V
C
.
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
fixed signal handlin
g
in
m
d_openmm
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
M
e
rge b
r
anch 'master' of git@git
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-12
Szil
a
rd Pal
l
m
inor f
i
xes in docum
e
ntatio
n
+ so
m
e debuggi
n
g code
.
.
.
commit
|
commitdiff
|
tree
2010-05-12
Szilard Pall
ad
d
ed os-spec
i
f
ic define
s
from cmake
required by memtestG80
commit
|
commitdiff
|
tree
2010-05-10
Szilard Pall
MS
V
C fix for gm
x
_parallel_3dfft
.
c
commit
|
commitdiff
|
tree
2010-05-10
Szilard P
a
l
l
only issue
ope
n
m
m const
r
ints w
a
rning if co
n
st
r
ainsta
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
Szilard P
a
ll
Merge branch 'mast
e
r' of git@git
.
g
romacs
.
org:
g
romacs
commit
|
commitdiff
|
tree
2010-05-07
Szilard
P
a
ll
temporary fix
f
o
r
c
o
m
pilatio
n
err
o
r
with GMX_
O
P
E
N
M
M=ON
commit
|
commitdiff
|
tree
2010-05-07
Szi
l
ard
P
a
l
l
Merge bra
n
ch 'mas
t
er' of git@git
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-05-07
Szi
l
a
r
d Pall
Merge branch 'master' of git
@
git
.
gr
o
macs
.
o
r
g
:gromac
s
commit
|
commitdiff
|
tree
2010-05-07
S
z
i
lard P
a
ll
added gromac
s
file heade
r
s to the OpenMM-related f
i
les
commit
|
commitdiff
|
tree
2010-05-07
Sz
i
lard Pall
minor fixe
s
, documentat
i
on and
s
light API change in
.
.
.
commit
|
commitdiff
|
tree
2010-05-07
S
z
i
l
ard Pall
m
in
o
r updates to
FindGit and FindOpenMM
commit
|
commitdiff
|
tree
2010-05-07
Szila
r
d
Pall
up
d
at
e
d FindCUDA to version from cmake 2
.
8
.
1
f
or CUDA
.
.
.
commit
|
commitdiff
|
tree
2010-04-20
Szilard Pall
Me
r
ge branch 'maste
r
'
of git@git
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-04-20
S
z
ilard Pa
l
l
d
o
x
y
gen comments for th
e
Open
M
M
p
art
commit
|
commitdiff
|
tree
2010-04-16
Szilard Pal
l
added d
o
cume
n
t
a
tion
f
or
t
he op
e
nmm_wrapper
commit
|
commitdiff
|
tree
2010-04-16
S
zilard
Pall
form
a
tting f
i
x
of ope
n
mm w
r
apper
-
gromacsifie
d
th
e
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szil
a
rd Pall
cleaned up a
b
unch
o
p mess
i
n
d
o_md_o
p
en
m
m
commit
|
commitdiff
|
tree
2010-04-13
Szil
a
rd Pall
bugfix
f
or do
_
md_openm
m
- w
a
s al
w
ays pul
l
ing
d
ata from
.
.
.
commit
|
commitdiff
|
tree
2010-04-13
Szilard Pa
l
l
fix
e
d
timi
n
g bug in do_md_
o
penmm
commit
|
commitdiff
|
tree
2010-04-13
Szil
a
rd Pall
added some more suppor
t
ed GPUs
(high-end mobile and
.
.
.
commit
|
commitdiff
|
tree
2010-04-06
Szilard Pall
Merge
b
ranch 'master' of git
@
git
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-04-06
Szilard
P
all
now g_bar
l
ooks
f
or l
a
mbda only
in the last dir
e
ctory
.
.
.
commit
|
commitdiff
|
tree
2010-04-04
Szilard Pall
Fixe
d
g_bar bug in lamb
d
a value parsing from
p
ath
.
commit
|
commitdiff
|
tree
2010-03-29
S
zilard P
a
ll
fixe
d
g
mxGenerateVer
s
ionI
n
f
o
.
cmake to produce 8 di
g
it
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
The
cmake development informati
o
n ge
n
er
a
ting
w
orks
.
.
.
commit
|
commitdiff
|
tree
2010-03-28
Sz
i
l
ard Pall
add
e
d
FindGit
.
cma
k
e scri
p
t
commit
|
commitdiff
|
tree
2010-03-28
Szilard Pall
fix
for
g
mxGen
e
rateVe
r
sionInfo
.
cmak
e
, now work
s
with
.
.
.
commit
|
commitdiff
|
tree
2010-03-25
Szilard Pall
fix
e
d U
S
E_VERSION_H Cma
k
e option
commit
|
commitdiff
|
tree
2010-03-18
Sz
i
l
a
rd Pall
Merge
b
r
a
n
ch 'master' of git
@
git
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-03-18
Szilard Pall
fixed t
h
e
problem o
f
version
.
c no
t
being built at the
.
.
.
commit
|
commitdiff
|
tree
2010-03-18
Szilar
d
Pall
added missing VERSION prefix
t
o _g
m
x
_
v
er_st
r
i
n
g
commit
|
commitdiff
|
tree
2010-03-16
Szilard Pall
fix
f
o
r
gen
v
ersi
o
n
.
sh to recogni
z
e the git://
.
.
.
/gromacs
.
.
.
commit
|
commitdiff
|
tree
2010-03-16
Szilar
d
Pall
Merge branch 'master'
of git@
g
it
.
g
r
omacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-03-16
Szila
r
d Pall
Cmake implementation to
ge
n
erate developm
e
nt build
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
OpenMM build not
d
epe
n
dent on
f
ftw anymore
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
fixed mdrun verb
o
sity wit
h
OpenMM build
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
fixed
a
miss
i
n
g c
o
mma
a
nd a typo in ope
n
m
m_wrapper
commit
|
commitdiff
|
tree
2010-03-11
Szil
a
rd
Pal
l
Delete src/ke
r
n
el/do_md_
o
penmm_nopatch
.
h
,
it's not
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Szilard Pall
Minor cleanup
,
some
re
a
rrangaments, and comme
n
ting
.
commit
|
commitdiff
|
tree
2010-03-11
S
z
ilard Pal
l
Reverted stupid
change in CMaleLists
.
txt
commit
|
commitdiff
|
tree
2010-03-11
Szil
a
rd Pall
Renamed md_openmm into openmm
_
wrapper
,
a
n
d
d
o
_
md_ope
n
m
m
.
.
.
commit
|
commitdiff
|
tree
2010-01-28
Szilard Pall
Fixed de
a
d
lo
c
k occuring in gmx_fatal
.
c:
introduc
e
d
.
.
.
commit
|
commitdiff
|
tree