This is great! Thanks, Drs. Crowley and Simmerling.
Cheers,
--Hang
----------------------------------------------------------------
On Thu, 26 Aug 2004, Michael Crowley wrote:
> Dear Nhat-hang,
> You can use binary output if you want full precision, but then
> you have binary files.
>
> Otherwise you need to change the formats in mdwrit and corpac
> like this one in mdwrit
>
> 9028 format(6f12.7)
>
> change to something like 6d25.15
>
> Hope that helps
> Mike
> -----------------------------------------------------------------
> Physical mail: Dr. Michael F. Crowley
> Department of Molecular Biology, TPC6
> The Scripps Research Institute
> 10550 North Torrey Pines Road
> La Jolla, California 92037
> Electronic mail: crowley.scripps.edu
> Telephone: 858/784-9290
> Fax: 858/784-8688
> -----------------------------------------------------------------
>
>
>
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Thu Sep 02 2004 - 01:15:11 PDT
