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Journal of Cheminformatics
|
March 13, 2022
Application of deep metric learning to molecular graph similarity
Damien E Coupry, Peter Pogány
The Journal of Chemical Physics
|
November 4, 2017
Explicit treatment of hydrogen bonds in the universal force field: Validation and application for metal-organic frameworks, hydrates, and host-guest complexes
Damien E Coupry, Matthew A Addicoat, Thomas Heine
Journal of Chemical Theory and Computation
|
September 1, 2016
Extension of the Universal Force Field for Metal-Organic Frameworks
Damien E Coupry, Matthew A Addicoat, Thomas Heine
The Journal of Physical Chemistry. A
|
September 11, 2014
AuToGraFS: automatic topological generator for framework structures
Matthew A Addicoat, Damien E Coupry, Thomas Heine
Journal of Chemical Information and Modeling
|
July 25, 2025
Benchmarking 3D Structure-Based Molecule Generators
Natasha Sanjrani, Damien E Coupry, Peter Pogány, et al.
Nature Communications
|
July 28, 2016
Multiple-component covalent organic frameworks
Ning Huang, Lipeng Zhai, Damien E Coupry, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 6) with videos related to
Sort By:
Page
of 1
Journal of Cheminformatics
|
March 13, 2022
Application of deep metric learning to molecular graph similarity
Damien E Coupry, Peter Pogány
The Journal of Chemical Physics
|
November 4, 2017
Explicit treatment of hydrogen bonds in the universal force field: Validation and application for metal-organic frameworks, hydrates, and host-guest complexes
Damien E Coupry, Matthew A Addicoat, Thomas Heine
Journal of Chemical Theory and Computation
|
September 1, 2016
Extension of the Universal Force Field for Metal-Organic Frameworks
Damien E Coupry, Matthew A Addicoat, Thomas Heine
The Journal of Physical Chemistry. A
|
September 11, 2014
AuToGraFS: automatic topological generator for framework structures
Matthew A Addicoat, Damien E Coupry, Thomas Heine
Journal of Chemical Information and Modeling
|
July 25, 2025
Benchmarking 3D Structure-Based Molecule Generators
Natasha Sanjrani, Damien E Coupry, Peter Pogány, et al.
Nature Communications
|
July 28, 2016
Multiple-component covalent organic frameworks
Ning Huang, Lipeng Zhai, Damien E Coupry, et al.
Page
of 1