Re: [Open Babel] obminimize outputs only in pdb (multimolecule pdb)

2017-10-19 Thread Geoffrey Hutchison
The obminimize program does not have all the features of the obabel command. You can naturally convert a PDB file to SDF: obabel file.pdb -O file.sdf > I tried -osdf filename.sdf and it didn't work. How can I get it in sdf format? > Or how can I convert multimolecule pdb file to an sdf file? Yo

Re: [Open Babel] obminimize outputs only in pdb (multimolecule pdb)

2017-10-19 Thread Sundar Jubilant
Thanks. I will try that. Sundar Thangapandian > On Oct 19, 2017, at 6:40 PM, Geoffrey Hutchison > wrote: > > The obminimize program does not have all the features of the obabel command. > You can naturally convert a PDB file to SDF: > > obabel file.pdb -O file.sdf > >> I tried -osdf filenam