Archives: Papers

Enhancing non-equilibrium molecular dynamics to model viscosity and density in linear and light branched alkanes

  • on July 3, 2020

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Practical applications of deep learning to impute heterogeneous drug discovery data

  • on June 22, 2020

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drug discovery

Imputation versus prediction: applications in machine learning for drug discovery

  • on April 6, 2020

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Predicting physical properties of alkanes with neural networks

  • on August 6, 2019

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Structure-Mechanical Stability Relations of Metal-Organic Frameworks via Machine Learning

  • on July 10, 2019

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Probabilistic neural network identification of an alloy for direct laser deposition

  • on April 15, 2019

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Imputation of Assay Bioactivity Data using Deep Learning

  • on February 12, 2019

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Materials data validation and imputation with an artificial neural network

  • on May 3, 2018

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Probabilistic design of a molybdenum-base alloy using a neural network

  • on March 15, 2018

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Jet Engine

Design of a nickel-base superalloy using a neural network

  • on October 5, 2017

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