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The Future of Retrosynthesis and Synthetic Planning: Algorithmic, Humanistic or the Interplay?

Authors : Madeleine A. Dallaston; Craig M. Williams

Subjects: Chemistry; Engineering ethics; General Chemistry

Source: Australian Journal of Chemistry. 74:291-326

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CNN-based two-branch multi-scale feature extraction network for retrosynthesis prediction

Authors : Feng Yang; Juan Liu; Qiang Zhang

Subjects: Structural Biology; Applied Mathematics; Research

Source: BMC bioinformatics. 23(1)

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Improving the performance of models for one-step retrosynthesis through re-ranking

Authors : Min Htoo Lin; Zhengkai Tu; Connor W. Coley ...

Subjects: Chemistry [Science]; Computer-Aided Synthesis Planning; Energy-Based Model

Source: Journal of cheminformatics. 14(1)

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Frontispiece: A Retrosynthesis Approach for Biocatalysis in Organic Synthesis

Authors : Rodrigo O. M. A. de Souza; Leandro S. M. Miranda; Uwe T. Bornscheuer

Subjects: chemistry.chemical_compound; Biotransformation; Biocatalysis

Source: Chemistry - A European Journal. 23

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A Retrosynthesis Approach for Biocatalysis in Organic Synthesis

Authors : Leandro S. M. Miranda; Rodrigo O. M. A. de Souza; Uwe T. Bornscheuer

Subjects: 010405 organic chemistry; Organic Chemistry; Enantioselective synthesis

Source: Chemistry (Weinheim an der Bergstrasse, Germany). 23(50)

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On Mineral Retrosynthesis of a Complex Biogenic Scaffold

Authors : José L. Arias; Helmut Cölfen; Ashit Rao

Subjects: 0301 basic medicine; Materials science; crystallization

Source: Inorganics; Volume 5; Issue 1; Pages: 16InorganicsArtículos CONICYTCONICYT Chileinstacron:CONICYTInorganics, Vol 5, Iss 1, p 16 (2017)

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Biocatalytic retrosynthesis

Authors : Elaine O'Reilly; Nicholas Turner

Subjects: Molecular Structure; Heptanoic Acids; Atorvastatin

Source: Nature chemical biology. 9(5)

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A Retrosynthetic Approach for Photocatalysis

Authors : Maciej Giedyk; Daniel Petzold; Burkhard König

Subjects: Chemistry; ddc:540; 540 Chemie

Source: European Journal of Organic Chemistry. 2020:1193-1244

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Transfer Learning: Making Retrosynthetic Predictions Based on a Small Chemical Reaction Dataset Scale to a New Level

Authors : Jiamin Ge; Ling Wang; Chengyun Zhang

Subjects: reactants; Chemistry, Pharmaceutical; Datasets as Topic

Source: MoleculesMolecules, Vol 25, Iss 2357, p 2357 (2020)Volume 25Issue 10

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Critical assessment of synthetic accessibility scores in computer-assisted synthesis planning

Authors : Grzegorz Skoraczyński; Mateusz Kitlas; Błażej Miasojedow

Subjects: Library and Information Sciences; Physical and Theoretical Chemistry; Computer Graphics and Computer-Aided Design

Source: Journal of Cheminformatics. 15

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فلترة النتائج

The Future of Retrosynthesis and Synthetic Planning: Algorithmic, Humanistic or the Interplay?

CNN-based two-branch multi-scale feature extraction network for retrosynthesis prediction

Improving the performance of models for one-step retrosynthesis through re-ranking

Frontispiece: A Retrosynthesis Approach for Biocatalysis in Organic Synthesis

A Retrosynthesis Approach for Biocatalysis in Organic Synthesis

On Mineral Retrosynthesis of a Complex Biogenic Scaffold

Biocatalytic retrosynthesis

A Retrosynthetic Approach for Photocatalysis

Transfer Learning: Making Retrosynthetic Predictions Based on a Small Chemical Reaction Dataset Scale to a New Level

Critical assessment of synthetic accessibility scores in computer-assisted synthesis planning

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