On 2015-11-18 05:05, Alexandre Fassio wrote:
> For example, a cellobiose can be represented as two glucoses (GLCs). Thus,
> it is difficult to know without a previous knowledge, which ligand is
> represented by these two GLCs.
>
> In another case, I had a PDB with 8 ligands covalently bonded and I
Dimitri Maziuk wrote
> On 11/17/2015 01:14 PM, Alexandre Fassio wrote:
>
>> I've tried to use the mmCIF but I wasn't able to convert a ligand in the
>> mmCIF format to MOL2 by using Open Babel.
>>
>> For some reason that I don't know, I always got the message "0 molecules
>> converted".
>
> Lik