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Delete src/kernel/do_md_openmm_nopatch.h, it's not relevant anymore.
2010-03-11
Szilar
d
Pall
Delete src/kernel
/
do
_
m
d_openm
m
_nopatch
.
h, it
'
s n
o
t
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Szilard
P
all
Minor cleanup, some rearrangaments, and commenting
.
commit
|
commitdiff
|
tree
2010-03-11
Szilar
d
Pall
R
e
verted stup
i
d change in CMale
L
ists
.
t
x
t
commit
|
commitdiff
|
tree
2010-03-11
Szilard
P
all
Renamed md_openmm into ope
n
mm_w
r
a
p
per
,
and do_md_openmm
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Rossen Apostolov
Reworked the
i
nte
g
r
a
tor and thermostat options
.
commit
|
commitdiff
|
tree
2010-03-11
Rosse
n
Apo
s
tolov
Fix
e
d
t
h
e w
r
o
n
g o
u
tp
u
t ti
m
e frames
commit
|
commitdiff
|
tree
2010-03-11
R
ossen Apostolo
v
do_md_opennmm
.
h (aka patched) now works
but the
t
im
e
.
.
.
commit
|
commitdiff
|
tree
2010-03-11
Ro
s
sen Apostol
o
v
Initial porting, do_md
_
o
p
enmm_nopatch
.
h is used
.
commit
|
commitdiff
|
tree
2009-10-02
Rossen Apostolov
Users are no
w
refere
d
to the ne
w
web
s
ite in case of
.
.
.
commit
|
commitdiff
|
tree
2009-08-17
Rossen Apostolov
Fixed incorrec
t
scali
n
g of forces in reciproc
a
l space
.
.
.
commit
|
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|
tree