Improving Performance Prediction of Electrolyte Formulations with Transformer-based Molecular Representation Model
- 2024
- arXiv
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442 results for Accelerated Discovery
Are we fitting data or noise? Analysing the predictive power of commonly used datasets in drug-, materials-, and molecular- discovery.
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- Faraday Discussions
A Framework for Cognitive, Decentralised Container Orchestration
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- IEEE Access
Vocal expression of emotions discriminates dementia with Lewy bodies from Alzheimer's disease
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Simulating CO2 diffusivity in rigid and flexible Mg-MOF-74 with machine-learning force fields
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- APL Mach. Learn.
A Physics Inspired Approach to the Understanding of Molecular Representations and Models
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- 2024
- MSDE
Chemical Space Analysis and Property Prediction for Carbon Capture Amine molecules
- James Mcdonagh
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- 2024
- Digital Discovery
CMD + V for Chemistry: Image to chemical structure conversion directly done in the clipboard.
- Oliver Schilter
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- 2024
- Appl. AI Lett.
TensorBank: Tensor Lakehouse for Foundation Model Training
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- et al.
- 2023
- Big Data 2023
Direct Sampling for Spatially Variable Extreme Event Generation in Resampling-Based Stochastic Weather Generators
- Jorge Guevara
- Maria Garcia
- et al.
- 2023
- J. Adv. Model. Earth Syst.