Don't really use that functionality but...
1. Aren't there no bonds in a PDBFile so getting separate fragments isn't
clear cut? If you have a sample file would help.
2. For the residue information you can cast the atoms to PDBAtom and access
info from there.
Regards,
John W May
john.wilkinson...@gmail.com
On 21 June 2016 at 17:25, Tim Dudgeon <tdudgeon...@gmail.com> wrote:
> I asked this question a while ago about reading PDB files but didn't get
> any response.
>
> https://sourceforge.net/p/cdk/mailman/message/35110892/
>
> Hoping someone might know the answer?
>
> Tim
>
>
>
>
>
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