Hello,
I'd like to implement four-point (or generally N-point) pharmacophores
into rdkit's Pharm2D module. It seems that same parts of the module can
support more-than-three-point pharmacophores without any modification,
while some other can't. Is there any more thorough documentation than
the
Hi Greg,
> There's an illustration of the representation here:
> http://rdkit.org/docs/RDKit_Book.html#representation-of-pharmacophore-fingerprints
> Some discussion in the code of the terminology used:
> https://github.com/rdkit/rdkit/blob/master/rdkit/Chem/Pharm2D/Generate.py#L11
> and an illust
