[gmx-users] more digits
David van der Spoel
spoel at xray.bmc.uu.se
Fri Jun 19 08:05:50 CEST 2009
Shuangxing Dai wrote:
> Hi, all,
> I need more digits to input information. But the default format of
> pdb file for coordinate is %8.3f. Can I modify the pdbio.c file to
> achive this goal? Or is there any other direct ways to input more digits
> coordinate information in Gromacs?
Use a g96 file.
> Thanks in advance.
> Shuangxing Dai
>
>
> ------------------------------------------------------------------------
>
> _______________________________________________
> gmx-users mailing list gmx-users at gromacs.org
> http://lists.gromacs.org/mailman/listinfo/gmx-users
> Please search the archive at http://www.gromacs.org/search before posting!
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org.
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php
--
David.
________________________________________________________________________
David van der Spoel, PhD, Professor of Biology
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://folding.bmc.uu.se
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
More information about the gromacs.org_gmx-users
mailing list