Chemical structure generation without GPU #chemoinformatics #STONED #rdkit

Generative model is very hot not only in computer vision, natural language processing but also chemoinformatics. As you know, recent version of deep learning based compound generator works very well but it is required huge computer resources for building the model. And also SMILES based approach sometime generates invalid molecules. Recently I read very interestingContinue reading “Chemical structure generation without GPU #chemoinformatics #STONED #rdkit”