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Improve awkward handling of GMX_CUDA_TARGET* help
2017-05-14
Ju
s
tin L
e
mkul
Clari
f
ic
a
t
i
ons
t
o editconf help text
.
commit
|
commitdiff
|
tree
2017-05-14
Just
i
n L
e
mkul
Clar
i
fi
c
a
t
i
ons to
e
d
itconf
help t
e
xt
.
commit
|
commitdiff
|
tree
2016-10-03
Justi
n
Lemkul
Fix inc
o
rr
e
c
t ch
a
r
ge in
H
ISE
.
commit
|
commitdiff
|
tree
2015-10-18
J
ustin L
e
mkul
Re
m
ov
e
d
d
ihedrals from GLY
.
r
t
p entry
.
commit
|
commitdiff
|
tree
2015-08-14
Justin Lemkul
Av
o
id segmentation fa
u
lt in gmx chi
.
commit
|
commitdiff
|
tree
2015-05-05
J
u
stin Lemkul
Fix
f
or trjc
o
n
v
preservi
n
g box dimens
i
ons
.
commit
|
commitdiff
|
tree
2014-11-09
Ju
s
tin
Lemkul
Remov
e
d
s
purious G
L
Y
dih
e
dral in AMBER03
.
commit
|
commitdiff
|
tree
2014-09-10
Ju
s
tin Le
m
kul
Added flat
-
bott
o
m cyli
n
drical rest
r
aints in x
a
nd y
.
commit
|
commitdiff
|
tree
2014-09-01
Justin Lemkul
Updated x-axis label
fo
r
g_
w
ham
.
commit
|
commitdiff
|
tree
2014-05-20
J
ustin L
e
mkul
Improv
e
men
t
s to t
h
e g
_
lie he
l
p
d
e
s
cription
.
commit
|
commitdiff
|
tree
2014-04-29
Ju
s
tin
Lemkul
M
a
d
e OR
C
A compile
.
commit
|
commitdiff
|
tree
2014-04-10
Ju
s
tin Lemkul
Fixed typo in
m
anual README
.
commit
|
commitdiff
|
tree
2014-04-09
Justin Lemkul
Fixed
MG typo in res
i
duet
y
pes
.
dat
commit
|
commitdiff
|
tree
2014-01-29
Justin L
e
mkul
Clarified use of table-extension
.
.
commit
|
commitdiff
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tree
2014-01-21
Ju
s
t
i
n
L
emkul
Added ASPP
a
nd GLUP to resid
u
etypes
.
dat
.
commit
|
commitdiff
|
tree
2013-07-25
Justin Lemkul
Update
d
d
l
ist
.
c to recog
n
ize mo
r
e
a
tom na
m
e
s
.
commit
|
commitdiff
|
tree
2013-06-28
J
ustin Lemkul
Min
o
r
t
weaks to qm_orca
.
c
commit
|
commitdiff
|
tree
2013-06-28
Justin Lemkul
Fi
x
es to config
.
h
.
c
m
akein
t
o
s
e
t G
M
X_QMMM_
O
RCA
.
commit
|
commitdiff
|
tree
2013-05-30
Ju
s
tin Le
m
kul
Adde
d
GROMOS96 54A7 force fi
e
ld files
.
commit
|
commitdiff
|
tree
2013-05-16
Jus
t
i
n
Lemkul
Fixed g_sgangl
e
legends
.
commit
|
commitdiff
|
tree
2013-03-05
J
ustin
L
e
m
kul
F
ixes for install guide
p
ag
e
.
commit
|
commitdiff
|
tree
2013-01-09
Just
i
n Lemkul
C
o
rrected gm
x
c
h
e
ck output for Gromos96 bonds
.
commit
|
commitdiff
|
tree
2013-01-05
Ju
s
t
i
n Lemk
u
l
R
e
moved reference
to nonexistent file in
g
_helix
.
commit
|
commitdiff
|
tree
2013-01-03
J
ustin Lemkul
Fixed for
m
at erro
r
in onli
n
e man
u
a
l
.
commit
|
commitdiff
|
tree
2012-12-27
J
u
stin
Lemku
l
M
i
nor fixes to
g_angle
hel
p
descriptio
n
.
commit
|
commitdiff
|
tree
2012-06-15
J
ustin Lem
k
u
l
S
i
mpl
e
patch for openmm_wrapper
.
cpp
commit
|
commitdiff
|
tree
2011-04-04
Justin Lemkul
A
f
ew more addi
t
ions to w
m
an
.
c to account
f
or symb
o
l
.
.
.
commit
|
commitdiff
|
tree
2011-03-30
J
u
stin Lemkul
Updated g_e
n
ergy help informati
o
n
.
commit
|
commitdiff
|
tree
2011-03-24
Justi
n
L
e
m
k
ul
Fixed incorrect reference in g_tcaf
.
commit
|
commitdiff
|
tree
2011-03-23
Justin Lemkul
Tons
of small fixes to documentation
.
commit
|
commitdiff
|
tree
2011-03-22
Justin Lemkul
Lots of e
d
itorial
f
ix
e
s to descriptio
n
s
, etc
.
to make
.
.
.
commit
|
commitdiff
|
tree
2011-03-16
Justin L
e
mkul
Mad
e
g_sgangle fatal error
a
bit mor
e
verbose
.
commit
|
commitdiff
|
tree
2011-03-01
Justi
n
L
e
mkul
Small fi
x
es
t
o g_dielect
r
i
c
description to improve
.
.
.
commit
|
commitdiff
|
tree
2011-02-26
Ju
s
tin
Lemkul
Another typo
.
commit
|
commitdiff
|
tree
2011-02-26
Justin Lemkul
Fixed s
o
me
typos in mdp_o
p
t
.
html
commit
|
commitdiff
|
tree
2011-02-25
Justin L
e
mkul
Fixed typo in cit
a
tion
.
commit
|
commitdiff
|
tree
2011-02-16
Justin Lemkul
Add -tu option to g_hbond
.
commit
|
commitdiff
|
tree
2011-02-15
J
ustin Lemkul
Smal
l
fi
x
to impr
o
ve
x
pm
2
ps outp
u
t
commit
|
commitdiff
|
tree
2011-02-03
Justin Lemkul
Fixed a typo
.
commit
|
commitdiff
|
tree
2011-01-24
Justin
L
emk
u
l
V
a
rious sm
a
l
l
changes
to the man pa
g
e
s
.
commit
|
commitdiff
|
tree
2011-01-23
Jus
t
in
Lemkul
Small
fix for e
d
i
t
conf related to formatting consiste
n
cy
.
commit
|
commitdiff
|
tree
2011-01-21
Justin
Lem
k
u
l
A
dde
d
g_p
m
e_e
r
ror to
p
rograms
.
tx
t
commit
|
commitdiff
|
tree
2011-01-21
J
ustin L
e
mkul
M
ore mino
r
format
t
i
n
g/edi
t
o
r
ial fixes for th
e
manual
.
commit
|
commitdiff
|
tree
2011-01-19
Ju
s
tin Lemkul
Fixes
t
o
g_wh
a
m d
o
c
u
m
enta
t
ion
.
commit
|
commitdiff
|
tree
2011-01-19
Justin Lemkul
Tons of tin
y
changes to documentation
.
Manual looks
.
.
.
commit
|
commitdiff
|
tree
2011-01-19
Justin Lemkul
T
r
i
v
i
al fixes to program desc
r
iptions
.
commit
|
commitdiff
|
tree
2011-01-18
Jus
t
in
L
emkul
F
ixe
s
to the demo script
.
commit
|
commitdiff
|
tree
2011-01-17
Justin Le
m
kul
Fixes to
methanol and mixed
d
emos
.
Issue ID
#669
commit
|
commitdiff
|
tree
2011-01-17
J
u
s
t
in Lemkul
Remo
v
ed non
-
e
x
istent pro
g
ram and redundant information
.
.
.
commit
|
commitdiff
|
tree
2011-01-17
J
u
s
ti
n
Lemk
u
l
Va
r
ious editorial
a
nd format
t
i
n
g fixes
commit
|
commitdiff
|
tree
2011-01-14
Jus
t
in
L
e
mkul
Fi
x
es
t
o grompp -m
a
x
w
arn doc
u
mentat
i
on
.
Issue ID #627
commit
|
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|
tree