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MF-DCCA between molecular properties and aqueous solubility

  • Published:2020-10 Issue: Volume:556 Page:124708
  • ISSN:0378-4371
  • Container-title:Physica A: Statistical Mechanics and its Applications
  • language:en
  • Short-container-title:Physica A: Statistical Mechanics and its Applications

Author:

Chen Hong,Zhu Li,Jia GuoZhu

Funder

Science and Technology Plan Application Basis Projects of Sichuan Province

Publisher

Elsevier BV

Subject

Condensed Matter Physics,Statistics and Probability

Reference44 articles.

1. Deep learning in drug discovery;Gawehn;Mol. Inform.,2016

2. From machine learning to deep learning: progress in machine intelligence for rational drug discovery;Zhang;Drug Discov. Today,2017

3. MoleculeNet: a benchmark for molecular machine learning;Wu;Chem. Sci.,2018

4. Low data drug discovery with one-shot learning;Altae-Tran;ACS Cent. Sci.,2017

5. Atomic convolutional networks for predicting protein-ligand binding affinity;Gomes,2017

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