On 17/08/2023 11:18, Palm, Gottfried wrote:
>
> I copied the EDO.cif from the library and changed the C1-C2 torsion
> angle definition to
> EDO sp3_sp3_4 O1 C1 C2
> O2 180.000 10.0 1
>
> After loading EDO in coot via "import cif dictionary
Dear all,
I have a problem in fine tuning the cif file for my new ligand. I
try to force a specific torsion angle, but coot doesn't "obey". The
ligand has more than 50 atoms , so I tried with simple ethane diol,
EDO.
I copied the EDO.cif from the library and changed the C1-C2 torsion
angle def
