Yao Xiao
Yao Xiao
> The PubChemPy documentation (https://pubchempy.readthedocs.io/en/latest/guide/properties.html) outlines the properties that can be retrieved. It may not cover all of the physical properties that you seek. > > > The get_properties function...
> I wrote a script to get out pKa of compounds on Pubchem. Because pKa and odor are in the same category, I think the code to get odor would...
Hi guys, I am trying to figure out how to construct a molecule graph with bond information, but I am confused about how the decoder is modeled by three different...
Thank you so much. I will try it out.
> I won't have time to look into this for awhile. It sounds like you understand what ought to happen, so feel free to submit a pull request. Sounds good....
I also encountered the same problem. Is there any follow-up on this issue?