Replies: 1 comment
-
Hi, welcome to the community! A scoring component is simply a piece of code which returns an array of scores for each endpoint. The array can be of type float or str. In the case of str you would need to convert the str label with the Cheers, |
Beta Was this translation helpful? Give feedback.
0 replies
Sign up for free
to join this conversation on GitHub.
Already have an account?
Sign in to comment
-
Does my new scoring plugin have to be a parameter that can be obtained from rdkit?
I am not in the field of biomedical research. My molecules require parameters such as HOMO,LUMO,ESP(electrostatic potential). Can I add them?
Beta Was this translation helpful? Give feedback.
All reactions