Hi Sebastien,
If you have multiple poses of the same molecule in your sdf file, you
can translate them into a multi-model PDB file, writing the score and
rmsd values to the bfactor and occupancy field. This you can then load
into pymol, allowing you to step through the poses. With the command
'spe
dear all,
i try to find a way of displaying data about molecules
contained in a sdf file (score and rmsd values of docked
poses) - at the best as labels.
in the mailing list i only find information about displaying
the title or splitting the sdf. i would like to keep the
multimolecular charac
