Search research articles
Contact Us
Filters
Showing results (1-10 of 5) with videos related to
Page
of 1
Sort By:
Inorganic Chemistry
|
February 11, 2017
DFT Analysis of Spin Crossover in Mn(III) Complexes: Is a Two-Electron S = 2 to S = 0 Spin Transition Feasible?
Silvia Amabilino, Robert J Deeth
Journal of Chemical Information and Modeling
|
July 14, 2020
Guidelines for Recurrent Neural Network Transfer Learning-Based Molecular Generation of Focused Libraries
Silvia Amabilino, Peter Pogány, Stephen D Pickett, et al.
Journal of Chemical Theory and Computation
|
July 26, 2018
Adaptively Accelerating Reactive Molecular Dynamics Using Boxed Molecular Dynamics in Energy Space
Robin J Shannon, Silvia Amabilino, Mike O'Connor, et al.
The Journal of Chemical Physics
|
October 23, 2020
Training atomic neural networks using fragment-based data generated in virtual reality
Silvia Amabilino, Lars A Bratholm, Simon J Bennie, et al.
The Journal of Physical Chemistry. A
|
March 21, 2019
Training Neural Nets To Learn Reactive Potential Energy Surfaces Using Interactive Quantum Chemistry in Virtual Reality
Silvia Amabilino, Lars A Bratholm, Simon J Bennie, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
Inorganic Chemistry
|
February 11, 2017
DFT Analysis of Spin Crossover in Mn(III) Complexes: Is a Two-Electron S = 2 to S = 0 Spin Transition Feasible?
Silvia Amabilino, Robert J Deeth
Journal of Chemical Information and Modeling
|
July 14, 2020
Guidelines for Recurrent Neural Network Transfer Learning-Based Molecular Generation of Focused Libraries
Silvia Amabilino, Peter Pogány, Stephen D Pickett, et al.
Journal of Chemical Theory and Computation
|
July 26, 2018
Adaptively Accelerating Reactive Molecular Dynamics Using Boxed Molecular Dynamics in Energy Space
Robin J Shannon, Silvia Amabilino, Mike O'Connor, et al.
The Journal of Chemical Physics
|
October 23, 2020
Training atomic neural networks using fragment-based data generated in virtual reality
Silvia Amabilino, Lars A Bratholm, Simon J Bennie, et al.
The Journal of Physical Chemistry. A
|
March 21, 2019
Training Neural Nets To Learn Reactive Potential Energy Surfaces Using Interactive Quantum Chemistry in Virtual Reality
Silvia Amabilino, Lars A Bratholm, Simon J Bennie, et al.
Page
of 1