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A Priori Estimation of Organic Reaction Yields.

artículo científico publicado en 2015

Automatic mapping of atoms across both simple and complex chemical reactions

artículo científico publicado en 2019

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

artículo científico publicado en 2018

Computational planning of the synthesis of complex natural products

artículo científico publicado en 2020

Computational prediction of complex cationic rearrangement outcomes

artículo científico publicado en 2023

Computer-Assisted Planning of Hydroxychloroquine’s Syntheses Commencing from Inexpensive Substrates and Bypassing Patented Routes

article published in 2020

Computer-Assisted Synthetic Planning: The End of the Beginning.

artículo científico publicado en 2016

Computer-designed repurposing of chemical wastes into drugs

artículo científico publicado en 2022

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

scientific article published on 10 June 2020

Discovery and Enumeration of Organic-Chemical and Biomimetic Reaction Cycles within the Network of Chemistry

artículo científico publicado en 2018

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

Linguistic measures of chemical diversity and the "keywords" of molecular collections.

artículo científico publicado en 2018

Predicting the outcomes of organic reactions via machine learning: are current descriptors sufficient?

artículo científico publicado en 2017

Suggestions for second-pass anti-COVID-19 drugs based on the Artificial Intelligence measures of molecular similarity, shape and pharmacophore distribution

artículo científico publicado en 2020

Synthetic connectivity, emergence, and self-regeneration in the network of prebiotic chemistry

artículo científico publicado en 2020

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

artículo científico publicado en 2019

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