On Wed, 23 Jul 2003, Karim Elsawy wrote:
>
> Prof Brian Ripley wrote:
> >
> > On Wed, 23 Jul 2003, Karim Elsawy wrote:
> >
> > > I wonder if there is a way to read a molecular dynamic trajectory file (
> > > binary file) produced by CHARMM into R. Something like that in matlab.
> > > Actually t
On Wed, 23 Jul 2003, Karim Elsawy wrote:
> Thanks a lot for your help, actually I do not know the exact file format
> at the moment
> all what I know is :
> "The DCD files (the trajectory files) are single precision binary
> FORTRAN files, so are transportable
> between computer architectures. The
Prof Brian Ripley wrote:
>
> On Wed, 23 Jul 2003, Karim Elsawy wrote:
>
> > I wonder if there is a way to read a molecular dynamic trajectory file (
> > binary file) produced by CHARMM into R. Something like that in matlab.
> > Actually this will save tremendous effort in post processing.
>
> I
On Wed, 23 Jul 2003, Karim Elsawy wrote:
> I wonder if there is a way to read a molecular dynamic trajectory file (
> binary file) produced by CHARMM into R. Something like that in matlab.
> Actually this will save tremendous effort in post processing.
If you know the file format, yes. That's a
dear helpers,
I wonder if there is a way to read a molecular dynamic trajectory file (
binary file) produced by CHARMM into R. Something like that in matlab.
Actually this will save tremendous effort in post processing.
best regards
karim
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