Pavan Behara

> Perhaps you've got strict channel priority active? I would suspect this is the case, if the channel order is changed to ``` channels: - psi4 - conda-forge ``` ,...

Another user encountered this recently (https://github.com/openmm/spice-dataset/issues/16), @Yoshanuikabundi do you think we can make it more explicit in the documentation. Another random thought, does adding an extra argument `mapped=True`, similar to...

installing both simultaneously with the following command worked for me, you can give this a try `conda create -n env_name -c conda-forge -c psi4/label/dev psi4 openff-toolkit`

> The generated charges are dependent on the input conformer, and the autogenerated input conformers are affected by atom order, toolkit backend, and other factors > I don't know where...

3. also, is there even a flexibility in the OE call to quacpac to turn off restraints? Edit: Never mind, I found this in openeye documentation ``` optimizationSetting = False...

> I think they are all about the details of implementing "ELF1" in OpenEye Apologies for conflating different things, I was thinking more about ELF1 addressing the electrostatic collapse for...

Making a note that new parameters with the smarts patterns "[#7X3+1]-[#6X4]" , "[#7X3+1]-[#7X3]" for central bonds in torsions, and "[#8X]=,:[#7X3+1]-[*]" for angle may cover these, until further discussion.

I think it is a new issue, mostly lack of parameters and not toolkit related.

Do you think this should be on forcefield tracker instead of here?

Just making a note for some failures, since these may not be important chemistries we can try to modify the general parameters to catch them - for molecules of type...