activity
20172019
most citedTuning the Molecular Weight Distribution from Atom Transfer Radical Polymerization Using Deep Reinforcement Learning

68 citations · 120 across the 4 of their papers we have counts for

collaborators
Showing 2017Show all

2 papers · 1 filter

physics.chem-ph2017★ 68 cited

Tuning the Molecular Weight Distribution from Atom Transfer Radical Polymerization Using Deep Reinforcement Learning

Haichen Li, Christopher R. Collins, Thomas G. Ribelli +4

We devise a novel technique to control the shape of polymer molecular weight distributions (MWDs) in atom transfer radical polymerization (ATRP). This technique makes use of recent…

physics.chem-ph2017★ 7 cited

Constant Size Molecular Descriptors For Use With Machine Learning

Christopher R. Collins, Geoffrey J. Gordon, O. Anatole von Lilienfeld +1

A set of molecular descriptors whose length is independent of molecular size is developed for machine learning models that target thermodynamic and electronic properties of molecul…