Concepedia

Reaction Rule Application

Reaction Rule Application is a systematic procedure within retrosynthetic analysis that instantiates the transformation of molecular structures by applying chemically validated transformation patterns to identify feasible synthetic pathways.

34

Publications

2.9K

Citations

138

Authors

64

Institutions

Publications per year

2017–2026

21

Parents

Publications

34

Neural‐Symbolic Machine Learning for Retrosynthesis and Reaction Prediction

Marwin Segler, Mark P. Waller · Chemistry - A European Journal · 2017 · 614 citations

, , +16

Route Designer: A Retrosynthetic Analysis Tool Utilizing Automated Retrosynthetic Rule Generation

James Law, Zsolt Zsoldos, Anikó Simon et al. · Journal of Chemical Information and Modeling · 2009 · 257 citations

, , +12

RetroPath2.0: A retrosynthesis workflow for metabolic engineers

Baudoin Delépine, Thomas Duigou, Pablo Carbonell et al. · Metabolic Engineering · 2017 · 253 citations · Full text

, , +11

GLORYx: Prediction of the Metabolites Resulting from Phase 1 and Phase 2 Biotransformations of Xenobiotics

Christina de Bruyn Kops, Martin Šícho, Angelica Mazzolari et al. · Chemical Research in Toxicology · 2020 · 146 citations · Full text

, , +17

RetroPrime: A Diverse, plausible and Transformer-based method for Single-Step retrosynthesis predictions

Xiaorui Wang, Yuquan Li, Jiezhong Qiu et al. · Chemical Engineering Journal · 2021 · 140 citations

, , +7

1–5 of 34

Authors

138

  1. BA
    Bartosz A. Grzybowski

    Northwestern University, United States

    2 publications · 96 citations

    2

    h-index

  2. EG
    Ewa Gajewska

    University of Łódź, Poland

    2 publications · 96 citations

    2

    h-index

  3. AP
    A. Peter Johnson

    University of Leeds, United Kingdom

    2 publications · 392 citations

    2

    h-index

  4. JL
    James Law

    University of Leeds, United Kingdom

    2 publications · 392 citations

    2

    h-index

  5. AS
    Anikó Simon

    Holografika (Hungary), Hungary

    2 publications · 392 citations

    2

    h-index

1–5 of 138

Institutions

64

  1. Ulsan National Institute of Science and Technology

    Ulsan, South Korea

    2 h-index

    2 publications

    96 citations

  2. Institute of Organic Chemistry

    Warsaw, Poland

    2 h-index

    8 publications

    384 citations

  3. Massachusetts Institute of Technology

    Cambridge, United States

    2 h-index

    4 publications

    150 citations

  4. Dalian University of Technology

    Dalian, China

    2 h-index

    13 publications

    743 citations

  5. University of Leeds

    Leeds, United Kingdom

    2 h-index

    12 publications

    2.8K citations

  6. Polish Academy of Sciences

    Warsaw, Poland

    2 h-index

    8 publications

    384 citations

  7. Institute of Macromolecular Chemistry

    Kyiv, Ukraine

    1 h-index

    2 publications

    26 citations

  8. AgroParisTech

    Palaiseau, France

    1 h-index

    1 publications

    253 citations

1–8 of 64

Venues

  1. Journal of Chemical Information and Modeling

    JCIM · 5 publications · 608 citations

    5

    h-index

  2. 2

    h-index

  3. Combustion and Flame

    2 publications · 112 citations

    2

    h-index

  4. Computers & Chemical Engineering

    2 publications · 52 citations

    2

    h-index

  5. Metabolic Engineering

    1 publications · 253 citations

    1

    h-index

1–5