MOESM5 of Nonpher: computational method for design of hard-to-synthesize structures
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Additional file 5. DR training set. It contains SMILES of 50,345 hard-to-synthesize structures (i.e., they are from a sparse region) and of 113,176 easy-to-synthesize structures (i.e., they are from a dense region).
创建时间：
2017-03-21
