Brett M. Savoie

发表

A Transfer Learning Framework for Improving Property Prediction, Interpretability, and Chemical Discovery from Scarce Datasets

Brett M. Savoie, 2020 .

Improving the generative performance of chemical autoencoders through transfer learning

Brett M. Savoie, Nicolae C. Iovanac, B. Savoie, 2020, Mach. Learn. Sci. Technol..

Topology Automated Force-Field Interactions (TAFFI): A Framework for Developing Transferable Force Fields

Brett M. Savoie, Qiyuan Zhao, Bumjoon Seo, 2021, J. Chem. Inf. Model..

Simultaneously improving reaction coverage and computational cost in automated reaction prediction tasks

Brett M. Savoie, Qiyuan Zhao, B. Savoie, 2021, Nature Computational Science.

Actively Searching: Inverse Design of Novel Molecules with Simultaneously Optimized Properties.

Brett M. Savoie, Nicolae C. Iovanac, R MacKnight, 2021, The journal of physical chemistry. A.

Transferable Ring Corrections for Predicting Enthalpy of Formation of Cyclic Compounds

Brett M. Savoie, Qiyuan Zhao, Nicolae C. Iovanac, 2021, J. Chem. Inf. Model..

Systematic Computational and Experimental Investigation of Lithium-Ion Transport Mechanisms in Polyester-Based Polymer Electrolytes

Brett M. Savoie, Thomas F. Miller, Geoffrey W. Coates, 2015, ACS central science.

Modeling geminate pair dissociation in organic solar cells: high power conversion efficiencies achieved with moderate optical bandgaps

Mark A. Ratner, Tobin J. Marks, Brett M. Savoie, 2012 .

Mesoscale molecular network formation in amorphous organic materials

Mark A. Ratner, George C. Schatz, Tobin J. Marks, 2014, Proceedings of the National Academy of Sciences.

Optimizing Ion Transport in Polyether-Based Electrolytes for Lithium Batteries

Brett M. Savoie, Thomas F. Miller, Geoffrey W. Coates, 2018 .