분자구조 이미지 SMILES 변환 AI 경진대회

[LG2대회] Introduction to RDKit Part 1

2020.09.06 21:17 5,561 Views

  

https://colab.research.google.com/drive/1fM88FMcTJytuMQwpDm392v2bmNQbZYNg


https://www.rdkit.org/docs/GettingStartedInPython.html


https://molecularmodelingbasics.blogspot.com/2016/05/a-brief-introduction-to-smiles-and-inchi.html


http://www.cheminfo.org/flavor/malaria/Utilities/SMILES_generator___checker/index.html


https://www.daylight.com/dayhtml/doc/theory/theory.smarts.html


https://sites.google.com/view/ml-basics/home