[Dock-fans] Announcing: Release of DOCK 6.2
Sudipto Mukherjee
sudmukh at yahoo.com
Thu Mar 6 09:04:50 PST 2008
Dear Ben,
>1.
Grid
Reading
Memory
Efficiency:
I
am
guessing
the
grid
files
themselves
>are
the
same
but
I
want
to
verify
that.
Can
I
run
dock6.2
with
grids
I
have
>generated
with
dock6.1,
or
do
I
need
to
regenerate
them?
The same grid files will still work.
>2.
Continuous
Score
Distance
Dependent
Dielectric
Control:
I
am
not
sure
>what
exactly
was
in
Dock6.1;
could
you
please
give
any
reference
to
the
>dielectric
function
used
in
dock6.2
(e.g.
epsilon(r)=)?
Or
can
I
view
its
>values
in
any
of
the
dock6.2
files?
All versions of Dock6 use 4r as the distance dependent dielectric.
Regards
Sudipto Mukherjee
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