Open Sulstice opened 1 year ago
Hi Sul!
For table 2, there are two columns. Which exactly am I working with, Botanical names or Chemical compositions?
Hi @Zainab-ik
Here is what I suggest:
1.) Make a branch of the repository and add it as a comment in your issue 2.) Follow Anul's instructions. Make a directory in medicinal_chemistry and called it ayuverda 3.) For each botanical name make a directory and inside make a python file. The chemical composition that is labeled in table 2 is the the chemical names. 4.) Find the SMILES for each of the names and any you can't find then ask here.
Hi @Zainab-ik
Here is what I suggest:
1.) Make a branch of the repository and add it as a comment in your issue 2.) Follow Anul's instructions. Make a directory in medicinal_chemistry and called it ayuverda 3.) For each botanical name make a directory and inside make a python file. The chemical composition that is labeled in table 2 is the the chemical names. 4.) Find the SMILES for each of the names and any you can't find then ask here.
Acknowledged
Hi @Sulstice
Or
So it'd be botanical name.py containing the chemical list and smiles. Which is the best way?
97320630003100S1_2.pdf
Here's the paper and we need to abstract table 2 I believe.