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Design rules for high mobility xanthene-based hole transport materials

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Automatic discovery of photoisomerization mechanisms with nanosecond machine learning photodynamics simulations

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Optical and Electrical Measurements Reveal the Orientation Mechanism of Homoleptic Iridium-Carbene Complexes

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Scientific intuition inspired by machine learning generated hypotheses

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Augmenting Genetic Algorithms with Deep Neural Networks for Exploring the Chemical Space

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

The influence of sorbitol doping on aggregation and electronic properties of PEDOT:PSS: a theoretical study

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Machine learning dihydrogen activation in the chemical space surrounding Vaska's complex

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Machine learning for rapid discovery of laminar flowchannel wall modifications that enhance heattransfer

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Periodic Reporting for period 2 - MolDesign (Molecule design for next generation solar cells using machine learning appr...

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

From Absorption Spectra to Charge Transfer in Nanoaggregates of Oligomers with Machine Learning

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Self-referencing embedded strings (SELFIES): A 100% robust molecular string representation

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Neural message passing on high order paths

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Graph neural networks in TensorFlow-Keras with RaggedTensor representation (kgcnn)

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

Disorder compensation controls doping efficiency in organic semiconductors

Project: MolDesign

Updated at: 28-04-2024

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Project acronym MolDesign

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Design rules for high mobility xanthene-based hole transport materials

Automatic discovery of photoisomerization mechanisms with nanosecond machine learning photodynamics simulations

Optical and Electrical Measurements Reveal the Orientation Mechanism of Homoleptic Iridium-Carbene Complexes

Scientific intuition inspired by machine learning generated hypotheses

Augmenting Genetic Algorithms with Deep Neural Networks for Exploring the Chemical Space

The influence of sorbitol doping on aggregation and electronic properties of PEDOT:PSS: a theoretical study

Machine learning dihydrogen activation in the chemical space surrounding Vaska's complex

Machine learning for rapid discovery of laminar flowchannel wall modifications that enhance heattransfer

Periodic Reporting for period 2 - MolDesign (Molecule design for next generation solar cells using machine learning appr...

From Absorption Spectra to Charge Transfer in Nanoaggregates of Oligomers with Machine Learning

Self-referencing embedded strings (SELFIES): A 100% robust molecular string representation

Neural message passing on high order paths

Graph neural networks in TensorFlow-Keras with RaggedTensor representation (kgcnn)

Disorder compensation controls doping efficiency in organic semiconductors