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Prediction of Major Regio‐, Site‐, and Diastereoisomers in Diels–Alder Reactions by Using Machine‐Learning: The Importance of Physically Meaningful Descriptors

Angewandte Chemie International Edition, 2019-03, Vol.58 (14), p.4515-4519

International ed. in English, 2019

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Synergy Between Expert and Machine‐Learning Approaches Allows for Improved Retrosynthetic Planning

Angewandte Chemie International Edition, 2020-01, Vol.59 (2), p.725-730

International ed. in English, 2020

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Computer-Assisted Synthetic Planning: The End of the Beginning

Angewandte Chemie (International ed.), 2016-05, Vol.55 (20), p.5904-5937

International ed. in English, 2016

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Computational planning of the synthesis of complex natural products

Nature (London), 2020-12, Vol.588 (7836), p.83-88

2020

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Computer-generated "synthetic contingency" plans at times of logistics and supply problems: scenarios for hydroxychloroquine and remdesivir

Chemical science (Cambridge), 2020-07, Vol.11 (26), p.6736-6744

2020

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Prediction of Major Regio‐, Site‐, and Diastereoisomers in Diels–Alder Reactions by Using Machine‐Learning: The Importance of Physically Meaningful Descriptors

Angewandte Chemie, 2019-03, Vol.131 (14), p.4563-4567

2019

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The logic of translating chemical knowledge into machine-processable forms: a modern playground for physical-organic chemistry

Reaction chemistry & engineering, 2019-09, Vol.4 (9), p.156-1521

2019

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Propagation of Oscillating Chemical Signals through Reaction Networks

Angewandte Chemie International Edition, 2019-03, Vol.58 (14), p.4520-4525

International ed. in English, 2019

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Algorithmic Discovery of Tactical Combinations for Advanced Organic Syntheses

Chem, 2020-01, Vol.6 (1), p.280-293

2020

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Synergy Between Expert and Machine‐Learning Approaches Allows for Improved Retrosynthetic Planning

Angewandte Chemie, 2020-01, Vol.132 (2), p.735-740

2020

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Computergestützte Syntheseplanung: Das Ende vom Anfang

Angewandte Chemie, 2016-05, Vol.128 (20), p.6004-6040

2016

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Propagation of Oscillating Chemical Signals through Reaction Networks

Angewandte Chemie, 2019-03, Vol.131 (14), p.4568-4573

2019

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Chematica: A Story of Computer Code That Started to Think like a Chemist

Chem, 2018-03, Vol.4 (3), p.390-398

2018

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Computer-generated “synthetic contingency” plans at times of logistics and supply problems: scenarios for hydroxychloroquine and remdesivir† †Electronic supplementary information (ESI) available. See DOI: 10.1039/d0sc01799j

Chemical science (Cambridge), 2020-06, Vol.11 (26), p.6736-6744

2020

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Alternative method for the synthesis of imidazo[5,1-f][1,2,4]triazin-4(3H)-one—a substrate for the preparation of phosphodiesterase (5) inhibitors

Tetrahedron, 2013-01, Vol.69 (2), p.474-480

2013

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Alternative method for the synthesis of imidazo[5,1-f][1,2,4]triazin-4(3H)-oneaa substrate for the preparation of phosphodiesterase (5) inhibitors

Tetrahedron, 2013-01, Vol.69 (2), p.474-480

2013

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ChemInform Abstract: Computer‐Assisted Synthetic Planning: The End of the Beginning

ChemInform, 2016-06, Vol.47 (27), p.no-no

2016

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Computergestützte Syntheseplanung: Das Ende vom Anfang

Angewandte Chemie, 2016-05, Vol.128 (20), p.6004-6040

2016

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Identification of a new genetic variant (G231N, E232T, N235D) of peptidylarginine deiminase from P. gingivalis in advanced periodontitis

Frontiers in immunology, 2024-03, Vol.15, p.1355357-1355357

2024

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In vivo oestrogenic modulation of Egr1 and Pitx1 gene expression in female rat pituitary gland

Journal of molecular endocrinology, 2014-12, Vol.53 (3), p.355-366

2014

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Transfer with GP IIb/IIIa inhibitor tirofiban for primary percutaneous coronary intervention vs. on-site thrombolysis in patients with ST-elevation myocardial infarction (STEMI): a randomized open-label study for patients admitted to community hospitals

European heart journal, 2007-10, Vol.28 (20), p.2438-2448

2007

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Three pregnancies in a Marfan syndrome patient after a mitral and tricuspid valve surgery

Ginekologia polska, 2013-04, Vol.84 (4), p.314-317

2013

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Structure and properties of a trans-anti photodimer of 5-methylorotate

Canadian journal of chemistry, 1978-03, Vol.56 (6), p.824-830

1978

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Prediction of Major Regio‐, Site‐, and Diastereoisomers in Diels–Alder Reactions by Using Machine‐Learning: The Importance of Physically Meaningful Descriptors

Synergy Between Expert and Machine‐Learning Approaches Allows for Improved Retrosynthetic Planning

Computer-Assisted Synthetic Planning: The End of the Beginning

Computational planning of the synthesis of complex natural products

Computer-generated "synthetic contingency" plans at times of logistics and supply problems: scenarios for hydroxychloroquine and remdesivir

Prediction of Major Regio‐, Site‐, and Diastereoisomers in Diels–Alder Reactions by Using Machine‐Learning: The Importance of Physically Meaningful Descriptors

Efficient Syntheses of Diverse, Medicinally Relevant Targets Planned by Computer and Executed in the Laboratory

The logic of translating chemical knowledge into machine-processable forms: a modern playground for physical-organic chemistry

Propagation of Oscillating Chemical Signals through Reaction Networks

Algorithmic Discovery of Tactical Combinations for Advanced Organic Syntheses

Synergy Between Expert and Machine‐Learning Approaches Allows for Improved Retrosynthetic Planning

Computergestützte Syntheseplanung: Das Ende vom Anfang

Propagation of Oscillating Chemical Signals through Reaction Networks

Chematica: A Story of Computer Code That Started to Think like a Chemist

Computer-generated “synthetic contingency” plans at times of logistics and supply problems: scenarios for hydroxychloroquine and remdesivir† †Electronic supplementary information (ESI) available. See DOI: 10.1039/d0sc01799j

Alternative method for the synthesis of imidazo[5,1-f][1,2,4]triazin-4(3H)-one—a substrate for the preparation of phosphodiesterase (5) inhibitors

Alternative method for the synthesis of imidazo[5,1-f][1,2,4]triazin-4(3H)-oneaa substrate for the preparation of phosphodiesterase (5) inhibitors

ChemInform Abstract: Computer‐Assisted Synthetic Planning: The End of the Beginning

Computergestützte Syntheseplanung: Das Ende vom Anfang

Identification of a new genetic variant (G231N, E232T, N235D) of peptidylarginine deiminase from P. gingivalis in advanced periodontitis

In vivo oestrogenic modulation of Egr1 and Pitx1 gene expression in female rat pituitary gland

Transfer with GP IIb/IIIa inhibitor tirofiban for primary percutaneous coronary intervention vs. on-site thrombolysis in patients with ST-elevation myocardial infarction (STEMI): a randomized open-label study for patients admitted to community hospitals

Three pregnancies in a Marfan syndrome patient after a mitral and tricuspid valve surgery

Structure and properties of a trans-anti photodimer of 5-methylorotate

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