[gmx-users] more digits

Mark Abraham Mark.Abraham at anu.edu.au
Fri Jun 19 04:10:36 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 for input. Virtually all GROMACS tools accept many
possible formats when a coordinate file is required.

Mark



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