[AI 독성예측] rdkit에서 사용할 수 있는 molecular Descriptor에 대하여
www.rdkit.org/docs/GettingStartedInPython.html#descriptor-calculation Getting Started with the RDKit in Python — The RDKit 2020.09.1 documentation [$([O,S;H1;v2;!$(*-*=[O,N,P,S])]),$([O,S;H0;v2]),$([O,S;-]),$([N;v3;!$(N-*=[O,N,P,S])]),n&H0&+0,$([o,s;+0;!$([o,s]:n);!$([o,s]:c:n)])] www.rdkit.org www.rdkit.org/docs/GettingStartedInPython.html#list-of-available-descriptors Getting Started with the ..