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H2O is an Open Source, Distributed, Fast & Scalable Machine Learning Platform: Deep Learning, Gradient Boosting (GBM) & XGBoost, Random Forest, Generalized Linear Modeling (GLM with Elastic Net), K…
Repository for generate descriptors, converting names of compounds on SMILES, creating gaussian input files
Master the command line, in one page
HCA algorithm to cluster objects by single linkage method.