[gmx-users] gromacs input file

Mark Abraham Mark.Abraham at anu.edu.au
Wed May 23 03:44:29 CEST 2012


On 23/05/2012 4:20 AM, Muyi Xu wrote:
> Hello
> I am trying to change a crystal structure(wih amc or cif format) into 
> a .pdb format; but gromacs gives me input/output error; which means my 
> input file has the wrong format. Do u have any suggestions how to 
> convert or what software to use?

Perhaps you can go back to the original source and get a .pdb file, or 
ask Google for options.

Mark



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