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Nature Computational Science
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January 4, 2024
High-throughput property-driven generative design of functional organic molecules
Julia Westermayr, Joe Gilkes, Rhyan Barrett, et al.
Journal of Chemical Theory and Computation
|
June 3, 2024
Predicting Long-Time-Scale Kinetics under Variable Experimental Conditions with Kinetica.jl
Joe Gilkes, Mark T Storr, Reinhard J Maurer, et al.
Journal of Chemical Information and Modeling
|
June 25, 2025
Structural Bias in Three-Dimensional Autoregressive Generative Machine Learning of Organic Molecules
Zsuzsanna Koczor-Benda, Joe Gilkes, Francesco Bartucca, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 3) with videos related to
Sort By:
Page
of 1
Nature Computational Science
|
January 4, 2024
High-throughput property-driven generative design of functional organic molecules
Julia Westermayr, Joe Gilkes, Rhyan Barrett, et al.
Journal of Chemical Theory and Computation
|
June 3, 2024
Predicting Long-Time-Scale Kinetics under Variable Experimental Conditions with Kinetica.jl
Joe Gilkes, Mark T Storr, Reinhard J Maurer, et al.
Journal of Chemical Information and Modeling
|
June 25, 2025
Structural Bias in Three-Dimensional Autoregressive Generative Machine Learning of Organic Molecules
Zsuzsanna Koczor-Benda, Joe Gilkes, Francesco Bartucca, et al.
Page
of 1