Concepedia

Molecular Docking Validation

Molecular Docking Validation is a methodological framework used to assess the accuracy and reliability of predicted molecular docking poses by comparing them against experimentally determined structural data.

1.2K

Publications

52.4K

Citations

6.1K

Authors

1.7K

Institutions

Publications per year

2017–2026

906

Parents

Publications

1.2K

Development and validation of a genetic algorithm for flexible docking 1 1Edited by F. E. Cohen

Gareth Jones, Peter Willett, Robert C. Glen et al. · Journal of Molecular Biology · 1997 · 6.7K citations

, , +14

DOCK 6: Impact of new features and current docking performance

William J. Allen, Trent E. Balius, Sudipto Mukherjee et al. · Journal of Computational Chemistry · 2015 · 839 citations

, , +17

Diverse, High-Quality Test Set for the Validation of Protein−Ligand Docking Performance

Michael J. Hartshorn, Marcel L. Verdonk, Gianni Chessari et al. · Journal of Medicinal Chemistry · 2007 · 642 citations

, , +16

Potential Inhibitor of COVID-19 Main Protease (M<sup>pro</sup>) From Several Medicinal Plant Compounds by Molecular Docking Study

Siti Khaerunnisa, Hendra Kurniawan, Rizki Awaluddin et al. · Preprints.org · 2020 · 454 citations · Full text

, , +17

Validation Studies of the Site-Directed Docking Program LibDock

Shashidhar N. Rao, Martha S. Head, Amit Kulkarni et al. · Journal of Chemical Information and Modeling · 2007 · 394 citations · Full text

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1–5 of 1.2K

Authors

6.1K

  1. SM
    S. Muthu

    Sri Venkateswara University, India

    26 publications · 1.3K citations

    20

    h-index

  2. CY
    C. Yohannan Panicker

    Fatima Mata National College, India

    24 publications · 911 citations

    17

    h-index

  3. CV
    Christian Van Alsenoy

    University of Antwerp, Belgium

    24 publications · 899 citations

    16

    h-index

  4. YS
    Y. Sheena Mary

    Fatima Mata National College, India

    20 publications · 775 citations

    15

    h-index

  5. ND
    Necmi Dege

    Ondokuz Mayıs University, Türkiye

    11 publications · 700 citations

    11

    h-index

1–5 of 6.1K

Institutions

1.7K

  1. King Saud University

    Riyadh, Saudi Arabia

    28 h-index

    108 publications

    3.9K citations

  2. Fatima Mata National College

    Kollam, India

    17 h-index

    42 publications

    1.5K citations

  3. University of Antwerp

    Antwerp, Belgium

    17 h-index

    25 publications

    918 citations

  4. National Research Centre

    Giza, Egypt

    16 h-index

    62 publications

    2K citations

  5. Mangalore University

    Mangaluru, India

    15 h-index

    38 publications

    1.4K citations

  6. Aligarh Muslim University

    Aligarh, India

    15 h-index

    60 publications

    3.4K citations

  7. Al-Azhar University

    Cairo, Egypt

    15 h-index

    43 publications

    1.6K citations

  8. Cairo University

    Giza, Egypt

    15 h-index

    44 publications

    1.2K citations

1–8 of 1.7K

Venues

  1. Journal of Molecular Structure

    151 publications · 5K citations

    39

    h-index

  2. 29

    h-index

  3. 22

    h-index

  4. Molecules

    34 publications · 1.5K citations

    21

    h-index

  5. Journal of Molecular Liquids

    26 publications · 919 citations

    19

    h-index

1–5