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Fixed compilation issue corresponding to bug 468
2010-07-15
Da
v
id va
n
der Spoel
Fix
e
d co
m
pilat
i
o
n issue correspondi
n
g t
o
b
u
g 4
6
8
commit
|
commitdiff
|
tree
2010-07-13
D
avid van
d
er Spoel
Fi
x
ed
b
ug 466 by co
m
mentin
g
out
the offending line
s
.
.
.
commit
|
commitdiff
|
tree
2010-07-08
Davi
d
van der Spoel
M
e
rge branch 'master' o
f
git
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-07-08
Da
v
id van der Spoel
Added
bondedtyp
e
s section
to rtp file
s
.
I
t
might be
.
.
.
commit
|
commitdiff
|
tree
2010-07-03
Dav
i
d
v
a
n der Spoel
Fixed include statements such that
double
p
r
ecision
.
.
.
commit
|
commitdiff
|
tree
2010-07-02
D
a
vid van de
r
S
poel
Me
r
ge br
a
nch 'm
a
s
t
er
'
of
git
.
gro
m
acs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-07-02
David van d
e
r
Spoel
Made rem
o
ving
p
b
c non-s
t
atic
.
This affect
s
many analysis
.
.
.
commit
|
commitdiff
|
tree
2010-07-02
David van
der Spoel
Me
r
ge bran
c
h 'master' of gi
t
.
gromacs
.
org:g
r
o
m
acs
commit
|
commitdiff
|
tree
2010-07-02
Da
v
id van der Spoel
Fixe
d
bug http://bugzilla
.
gromacs
.
org/show_bug
.
cgi
.
.
.
commit
|
commitdiff
|
tree
2010-06-30
David van der Spoel
Fixed ht
t
p
:
//bugzilla
.
gromacs
.
org/s
h
ow_bu
g
.
c
gi?
i
d
=457
.
.
.
commit
|
commitdiff
|
tree
2010-06-30
David van der Spoel
Merge branch '
m
aste
r
' of git
.
gromacs
.
o
r
g:gromacs
commit
|
commitdiff
|
tree
2010-06-30
D
a
vid v
a
n der
S
p
oel
Fixed bug in b
-
factors output by g_
c
onfrms
.
Th
e
y were
.
.
.
commit
|
commitdiff
|
tree
2010-06-27
David
v
an der Spoel
Added
missing
argument
step to tro
t
ter_update
.
H
o
w
.
.
.
commit
|
commitdiff
|
tree
2010-06-27
David van
der Spoel
M
e
rge br
a
n
c
h 'mast
e
r' of gi
t
.
gro
m
acs
.
o
r
g:groma
c
s
commit
|
commitdiff
|
tree
2010-06-27
David van der Spoel
Update
d
CMak
e
Lists
.
txt
i
n ngmx
directory to
e
xclude
.
.
.
commit
|
commitdiff
|
tree
2010-06-27
David van der Sp
o
el
Fixed m
a
ny
i
ssu
e
s regarding to compilation with C+
.
.
.
commit
|
commitdiff
|
tree
2010-06-18
David van der Spo
e
l
Fixed Makefile
.
am leading to warnings
.
commit
|
commitdiff
|
tree
2010-06-14
David v
a
n
d
er Spoel
F
i
xed make_ed
i
.
c
commit
|
commitdiff
|
tree
2010-06-14
David
v
a
n
der Spoel
Me
r
ge branch 'ma
s
te
r
' of
git
.
gromacs
.
or
g
:g
r
omacs
commit
|
commitdiff
|
tree
2010-06-14
David va
n
der Spoe
l
A
dded more fixe
s
in com
m
ent texts, generou
s
ly provided
.
.
.
commit
|
commitdiff
|
tree
2010-06-12
Davi
d
v
an
der Spoe
l
Fixed a lot
o
f spel
l
ing errors in comments and documentation
.
.
.
commit
|
commitdiff
|
tree
2010-06-11
Da
v
id van der Spoel
M
e
rge
b
r
anc
h
'm
a
ster' of git
.
gromacs
.
org
:
gromacs
commit
|
commitdiff
|
tree
2010-06-11
David
v
an
d
er Spoe
l
F
i
x
ed force
f
ield f
i
les for ATP in order
to clear bug
commit
|
commitdiff
|
tree
2010-06-10
David va
n
der Spoel
Merge
b
ran
c
h 'master' of git
.
gro
m
acs
.
org:gromacs
commit
|
commitdiff
|
tree
2010-06-10
David van
der Sp
o
el
Made legend more o
r
less work in g_chi
.
Don't know
.
.
.
commit
|
commitdiff
|
tree
2010-06-10
David van der S
p
oel
Fixed SEGV in g_chi as describ
e
d in bug
430
.
commit
|
commitdiff
|
tree
2010-06-10
David van der
S
poel
Added option -no
p
b
c
to g_rms
d
ist in order t
o
fix
commit
|
commitdiff
|
tree
2010-06-10
David van
d
e
r S
p
oe
l
Pedantic change i
n
the check whether a f
i
lenam
e
i
s
.
.
.
commit
|
commitdiff
|
tree
2010-06-10
David van der Spoel
R
enamed som
e
pr
o
grams t
o
follow t
h
e g_ doctrine
:
l
u
ck
.
.
.
commit
|
commitdiff
|
tree
2010-06-10
David van d
e
r Spoel
Cleane
d
up and rename
d
files
i
n n
g
mx d
i
rector
y
to
b
etter
.
.
.
commit
|
commitdiff
|
tree
2010-06-10
David van der Spoe
l
R
enamed some files in a roundabout way t
o
a
dh
e
r
e
to
.
.
.
commit
|
commitdiff
|
tree
2010-06-10
David van
d
er
Sp
o
e
l
Removed average
.
c,
t
hat funct
i
onality is now
i
n
g_analyze
.
commit
|
commitdiff
|
tree
2010-06-10
Davi
d
van der Spoel
Fixed str
a
nge typo in gmx_dih
.
c
commit
|
commitdiff
|
tree
2010-06-06
D
a
vi
d
van der Spo
e
l
Mov
e
d
w
arn
i
ng message i
n
add_
a
to
m
ty
p
e to be printed
.
.
.
commit
|
commitdiff
|
tree
2010-06-03
David van d
e
r Spoel
Made x2top (very) slight
l
y functio
n
al a
g
a
in
.
S
t
i
ll
.
.
.
commit
|
commitdiff
|
tree
2010-06-02
David van der Spoe
l
Changed
err
o
r
m
essa
g
e for settle problems, such that
.
.
.
commit
|
commitdiff
|
tree
2010-06-02
David va
n
d
e
r Spo
e
l
Added explicit
angle
i
n ACE
declaration
i
n
g
r
omacs
.
.
.
commit
|
commitdiff
|
tree
2010-06-02
David van
der Sp
o
el
Fixe
d
ty
p
e in
gmx_morph
.
c: efTRO -> efTR
X
which
lead
.
.
.
commit
|
commitdiff
|
tree
2010-06-02
David v
a
n der Spo
e
l
Fixed b
u
g 3
9
6
.
In fact it was already fixed
p
artl
y
.
commit
|
commitdiff
|
tree
2010-05-25
D
a
v
i
d v
a
n
der
S
poel
Merge branch 'maste
r
' of git
.
gr
o
macs
.
o
r
g:g
r
omacs
commit
|
commitdiff
|
tree
2010-05-25
Dav
i
d van der Spoel
Added one more!
commit
|
commitdiff
|
tree
2010-05-21
David
v
a
n
d
er Spoel
Fixed
compilation
wa
r
nings and removed sp
u
ri
o
us
C+
.
.
.
commit
|
commitdiff
|
tree
2010-05-20
D
avid
v
a
n de
r
Spoel
M
a
d
e
g_analyze c
o
mpile again,
b
ut ot link yet
.
commit
|
commitdiff
|
tree
2010-05-19
David
v
a
n
der Spoel
Merge
b
ranch 'master'
o
f g
i
t
.
gro
m
acs
.
org:gro
m
acs
commit
|
commitdiff
|
tree
2010-05-19
Dav
i
d van der Spoel
Added ch
e
ck in read_pdb f
o
r existence
of
t_
r
es
i
nfo
.
.
.
commit
|
commitdiff
|
tree
2010-05-18
D
avid van der Spoel
Added a coo
l
quot
e
, and removed two
c
o
mma's in openmp
.
.
.
commit
|
commitdiff
|
tree
2010-05-16
David van der Spoel
Mer
g
e
branch 'ma
s
ter' of git
.
gromacs
.
org
:
g
romac
s
commit
|
commitdiff
|
tree
2010-05-16
D
a
v
id van
der Sp
o
el
Fi
x
ed scatt
e
ring function co
d
e in
g
_rdf
.
A new file
.
.
.
commit
|
commitdiff
|
tree
2010-04-30
David van de
r
Spoel
Added
on
e
commit
|
commitdiff
|
tree
2010-04-04
D
a
vid van der Spoel
Added one
.
commit
|
commitdiff
|
tree
2010-04-04
David van der Spoel
Merge
b
ranc
h
'master' of git
.
g
rom
a
cs
.
org:gromac
s
commit
|
commitdiff
|
tree
2010-03-12
Dav
i
d van der Spoel
Merge br
a
nch 'master
'
of
g
it
.
gromacs
.
org:
g
romacs
commit
|
commitdiff
|
tree
2010-03-12
David
v
a
n
d
e
r Spoel
Added flush a
f
ter
w
ri
t
ing to de
b
ug file
commit
|
commitdiff
|
tree
2010-02-14
David van der Spoel
Added fun
c
tion t
o
increase the array siz
e
s in a t_
a
tom
s
.
.
.
commit
|
commitdiff
|
tree
2010-02-13
D
avid van der Spoel
Replace
d
so
m
e
s
trcp
y
by strncpy to avoid overflow
s
.
commit
|
commitdiff
|
tree
2010-02-06
D
a
v
id van de
r
S
poel
Replaced two strc
p
y by s
t
rncp
y
in pdbio
.
c
to preve
n
t
.
.
.
commit
|
commitdiff
|
tree
2009-12-14
David van
d
e
r
Spoel
Cha
n
ged at
o
mnumb
e
r for
O
S (
o
pls_1
7
9, opls_180) to 8
.
.
.
commit
|
commitdiff
|
tree
2009-12-07
D
a
vid
v
an der Spoel
M
e
rge bra
n
c
h 'master
'
of git
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2009-12-07
David van d
e
r Spoel
Update
d
commit
|
commitdiff
|
tree
2009-12-01
Davi
d
van der Sp
o
el
Added
i
nclude/vmdio
.
h to t
h
e in
s
tallable
headers due
.
.
.
commit
|
commitdiff
|
tree
2009-11-15
David van der Spoel
Added check for
chdi
r
retur
n
v
alue
.
commit
|
commitdiff
|
tree
2009-11-10
David
va
n
der Spoel
Added
2!!!
commit
|
commitdiff
|
tree
2009-09-18
D
a
vid
van der Spoel
Added a lot of help text
commit
|
commitdiff
|
tree
2009-09-18
David van der Spoel
R
emoved confusing --disa
b
le-n
i
ce
commit
|
commitdiff
|
tree
2009-09-18
David
v
an der Spoel
M
erge branch 'mas
t
er' of git
.
g
r
omacs
.
org:groma
c
s
commit
|
commitdiff
|
tree
2009-09-18
David va
n
der Spoel
Added functionality to change
directorie
s
a
n
d
back
.
.
.
commit
|
commitdiff
|
tree
2009-09-18
Dav
i
d van der Spoel
Fixed compilat
i
on iss
u
e
.
commit
|
commitdiff
|
tree
2009-09-15
David van d
e
r S
p
o
e
l
Made reg
u
lar histogram
f
o
r
g_clust
i
ze to r
e
present
.
.
.
commit
|
commitdiff
|
tree
2009-09-14
Dav
i
d van der
Spoel
Merg
e
branch 'master' of
g
i
t
.
groma
c
s
.
or
g
:gromacs
commit
|
commitdiff
|
tree
2009-09-14
David van der
S
po
e
l
M
a
de sta
t
istics work
w
ith
o
nly 1 da
t
a po
i
nt
commit
|
commitdiff
|
tree
2009-08-27
David van d
e
r Spoe
l
Merge
b
ranch 'ma
s
ter'
of g
i
t
.
gromacs
.
org:gromacs
commit
|
commitdiff
|
tree
2009-08-27
David van d
e
r Spoel
Made t
h
read stuff o
p
ti
o
n
al
commit
|
commitdiff
|
tree
2009-08-27
David van d
e
r
Spoel
Added m
i
ssi
n
g
f
ilena
m
e
commit
|
commitdiff
|
tree
2009-08-26
David van de
r
Spoel
Made comp
i
lab
l
e a
g
a
i
n
commit
|
commitdiff
|
tree
2009-07-19
David van der Spoel
Removed doubles
commit
|
commitdiff
|
tree
2009-07-10
David van der Spoe
l
Merge branch '
m
a
s
ter' of git@git
.
gromacs
.
o
r
g:grom
a
cs
commit
|
commitdiff
|
tree
2009-07-10
D
a
vid van
der Spo
e
l
Fix
e
d er
r
oneous checks for NULL poi
n
ters
.
commit
|
commitdiff
|
tree