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Author

Daniel J. Cole

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#graph neural networks Open access Sep 2026

Open Science for Molecular Modelling with the Open Force Field Initiative

Drawing on computational methods that are based around training to extensive condensed phase physical property and quantum mechanical datasets, I will describe some of our efforts to design accurate and transferable inter- and intra-molecular potentials, with a view to applications in condensed phase atomistic modellin...

Finlay Clark, Daniel J. Cole · 0 citations
#graph neural networks Open access Sep 2026

Open Science for Molecular Modelling with the Open Force Field Initiative

Drawing on computational methods that are based around training to extensive condensed phase physical property and quantum mechanical datasets, I will describe some of our efforts to design accurate and transferable inter- and intra-molecular potentials, with a view to applications in condensed phase atomistic modellin...

Finlay Clark, Daniel J. Cole · 0 citations

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