Concepedia

Docking Pose Ranking

Docking Pose Ranking is a computational method that evaluates and orders predicted molecular complex structures according to their likelihood of representing the biologically correct quaternary assembly based on energetic, statistical, or machine-learning criteria.

32

Publications

1.8K

Citations

107

Authors

47

Institutions

Publications per year

2017–2026

6

Parents

Publications

32

Consensus Docking: Improving the Reliability of Docking in a Virtual Screening Context

Douglas R. Houston, Malcolm D. Walkinshaw · Journal of Chemical Information and Modeling · 2013 · 264 citations

, , +16

Influence of Protonation, Tautomeric, and Stereoisomeric States on Protein−Ligand Docking Results

Tim ten Brink, Thomas E. Exner · Journal of Chemical Information and Modeling · 2009 · 173 citations

, , +17

Investigation of MM-PBSA Rescoring of Docking Poses

David C. Thompson, Christine Humblet, Diane Joseph‐McCarthy · Journal of Chemical Information and Modeling · 2008 · 126 citations

, , +17

A computational model of the inhibition of <i>Mycobacterium tuberculosis</i> ATPase by a new drug candidate R207910

Marc R. de Jonge, Luc Koymans, Jérôme Guillemont et al. · Proteins Structure Function and Bioinformatics · 2007 · 123 citations · Full text

, , +17

Importance of ligand conformational energies in carbohydrate docking: Sorting the wheat from the chaff

Anita K. Nivedha, Spandana Makeneni, B. Lachele Foley et al. · Journal of Computational Chemistry · 2013 · 90 citations

, , +17

1–5 of 32

Authors

107

  1. IH
    Iain H. Moal

    Universitat Politècnica de Catalunya, Spain

    2 publications · 62 citations

    2

    h-index

  2. PA
    Paulette A. Greenidge

    Novartis (Switzerland), Switzerland

    2 publications · 101 citations

    2

    h-index

  3. PA
    Paul A. Bates

    The Honourable Society of Lincoln's Inn, United Kingdom

    2 publications · 62 citations

    2

    h-index

  4. JF
    Juan Fernández‐Recio

    Universitat Politècnica de Catalunya, Spain

    2 publications · 105 citations

    2

    h-index

  5. CH
    Christine Humblet

    Pfizer (United States), United States

    2 publications · 185 citations

    2

    h-index

1–5 of 107

Institutions

47

  1. The Francis Crick Institute

    London, United Kingdom

    2 h-index

    5 publications

    144 citations

  2. Universitat Politècnica de Catalunya

    Barcelona, Spain

    2 h-index

    8 publications

    420 citations

  3. European Bioinformatics Institute

    Cambridge, United Kingdom

    2 h-index

    2 publications

    62 citations

  4. Wellcome Trust

    London, United Kingdom

    2 h-index

    2 publications

    62 citations

  5. Barcelona Supercomputing Center

    Barcelona, Spain

    2 h-index

    8 publications

    420 citations

  6. Novartis (Switzerland)

    Basel, Switzerland

    2 h-index

    4 publications

    129 citations

  7. Fraunhofer Institute for Molecular Biology and Applied Ecology

    Schmallenberg, Germany

    1 h-index

    2 publications

    30 citations

  8. Institute for Conflict Research

    Belfast, United Kingdom

    1 h-index

    1 publications

    10 citations

1–8 of 47

Venues

  1. Journal of Chemical Information and Modeling

    JCIM · 11 publications · 938 citations

    11

    h-index

  2. Proteins Structure Function and Bioinformatics

    3 publications · 153 citations

    3

    h-index

  3. Bioinformatics

    2 publications · 132 citations

    2

    h-index

  4. Journal of Computational Chemistry

    2 publications · 104 citations

    2

    h-index

  5. bioRxiv (Cold Spring Harbor Laboratory)

    Repository · 1 publications · 15 citations

    1

    h-index

1–5