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Scientific Reports
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May 10, 2022
Decoding the protein-ligand interactions using parallel graph neural networks
Carter Knutson, Mridula Bontha, Jenna A Bilbrey, et al.
Journal of Computational Chemistry
|
February 15, 2013
Exact ligand cone angles
Jenna A Bilbrey, Arianna H Kazez, Jason Locklin, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Exact Ligand Solid Angles
Jenna A Bilbrey, Arianna H Kazez, Jason Locklin, et al.
The Journal of Chemical Physics
|
March 22, 2023
Active sampling for neural network potentials: Accelerated simulations of shear-induced deformation in Cu-Ni multilayers
Henry W Sprueill, Jenna A Bilbrey, Qin Pang, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
August 14, 2014
Rapid electrochemical reduction of Ni(II) generates reactive monolayers for conjugated polymer brushes in one step
Anandi Roy, Jing Gao, Jenna A Bilbrey, et al.
Macromolecular Rapid Communications
|
September 13, 2012
Palladium-Mediated Surface-Initiated Kumada Catalyst Polycondensation: A Facile Route Towards Oriented Conjugated Polymers
N Eric Huddleston, S Kyle Sontag, Jenna A Bilbrey, et al.
Scientific Data
|
May 30, 2023
An open database of computed bulk ternary transition metal dichalcogenides
Scott E Muller, Micah P Prange, Zexi Lu, et al.
ACS Macro Letters
|
May 24, 2022
On the Role of Disproportionation Energy in Kumada Catalyst-Transfer Polycondensation
Jenna A Bilbrey, S Kyle Sontag, N Eric Huddleston, et al.
The Journal of Chemical Physics
|
July 17, 2020
A look inside the black box: Using graph-theoretical descriptors to interpret a Continuous-Filter Convolutional Neural Network (CF-CNN) trained on the global and local minimum energy structures of neutral water clusters
Jenna A Bilbrey, Joseph P Heindel, Malachi Schram, et al.
ACS Omega
|
March 17, 2020
Tracking the Chemical Evolution of Iodine Species Using Recurrent Neural Networks
Jenna A Bilbrey, Carlos Ortiz Marrero, Michel Sassi, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 18) with videos related to
Sort By:
Page
of 2
Scientific Reports
|
May 10, 2022
Decoding the protein-ligand interactions using parallel graph neural networks
Carter Knutson, Mridula Bontha, Jenna A Bilbrey, et al.
Journal of Computational Chemistry
|
February 15, 2013
Exact ligand cone angles
Jenna A Bilbrey, Arianna H Kazez, Jason Locklin, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Exact Ligand Solid Angles
Jenna A Bilbrey, Arianna H Kazez, Jason Locklin, et al.
The Journal of Chemical Physics
|
March 22, 2023
Active sampling for neural network potentials: Accelerated simulations of shear-induced deformation in Cu-Ni multilayers
Henry W Sprueill, Jenna A Bilbrey, Qin Pang, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
August 14, 2014
Rapid electrochemical reduction of Ni(II) generates reactive monolayers for conjugated polymer brushes in one step
Anandi Roy, Jing Gao, Jenna A Bilbrey, et al.
Macromolecular Rapid Communications
|
September 13, 2012
Palladium-Mediated Surface-Initiated Kumada Catalyst Polycondensation: A Facile Route Towards Oriented Conjugated Polymers
N Eric Huddleston, S Kyle Sontag, Jenna A Bilbrey, et al.
Scientific Data
|
May 30, 2023
An open database of computed bulk ternary transition metal dichalcogenides
Scott E Muller, Micah P Prange, Zexi Lu, et al.
ACS Macro Letters
|
May 24, 2022
On the Role of Disproportionation Energy in Kumada Catalyst-Transfer Polycondensation
Jenna A Bilbrey, S Kyle Sontag, N Eric Huddleston, et al.
The Journal of Chemical Physics
|
July 17, 2020
A look inside the black box: Using graph-theoretical descriptors to interpret a Continuous-Filter Convolutional Neural Network (CF-CNN) trained on the global and local minimum energy structures of neutral water clusters
Jenna A Bilbrey, Joseph P Heindel, Malachi Schram, et al.
ACS Omega
|
March 17, 2020
Tracking the Chemical Evolution of Iodine Species Using Recurrent Neural Networks
Jenna A Bilbrey, Carlos Ortiz Marrero, Michel Sassi, et al.
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of 2