Concepedia

Steric Descriptors

Steric Descriptors is a quantitative metric in computational chemistry that characterizes the spatial occupied volume and shape of molecular structures to differentiate bioisosteres based on their steric hindrance within structure-activity relationship modeling.

351

Publications

16K

Citations

1K

Authors

374

Institutions

Publications per year

2017–2026

46

Parents

Publications

351

Description of steric relationships across single bonds

W. Klyne, V. Prelog · Cellular and Molecular Life Sciences · 1960 · 701 citations

, , +12

Neighborhood Behavior:  A Useful Concept for Validation of “Molecular Diversity” Descriptors

David E. Patterson, Richard D. Cramer, Allan M. Ferguson et al. · Journal of Medicinal Chemistry · 1996 · 514 citations

, , +16

Polar and Steric Substituent Constants for Aliphatic and o-Benzoate Groups from Rates of Esterification and Hydrolysis of Esters<sup>1</sup>

Robert W. Taft · Journal of the American Chemical Society · 1952 · 507 citations

, , +9

Topological torsion: a new molecular descriptor for SAR applications. Comparison with other descriptors

Ramaswamy Nilakantan, Norman Bauman, Jonathan S. Dixon et al. · Journal of Chemical Information and Computer Sciences · 1987 · 383 citations

, , +17

Novel molecular descriptor for structure—property studies

Milan Randić · Chemical Physics Letters · 1993 · 371 citations

, , +13

1–5 of 351

Authors

1K

  1. BW
    Bertil Waldeck

    University of Gothenburg, Sweden

    4 publications · 202 citations

    4

    h-index

  2. YM
    Yovani Marrero‐Ponce

    Universidad Central "Marta Abreu" de las Villas (UCLV), Cuba

    4 publications · 72 citations

    4

    h-index

  3. NT
    Nenad Trinajstić

    Ruđer Bošković Institute, Croatia

    4 publications · 157 citations

    4

    h-index

  4. TI
    Tudor I. Oprea

    University of New Mexico, United States

    3 publications · 67 citations

    3

    h-index

  5. DJ
    Donald J. Cram

    University of California, Los Angeles, United States

    3 publications · 259 citations

    3

    h-index

1–5 of 1K

Institutions

374

  1. Universitat Rovira i Virgili

    Tarragona, Spain

    4 h-index

    13 publications

    432 citations

  2. Universitat de València

    Valencia, Spain

    4 h-index

    8 publications

    144 citations

  3. ETH Zurich

    Zurich, Switzerland

    4 h-index

    7 publications

    2K citations

  4. École Polytechnique Fédérale de Lausanne

    Lausanne, Switzerland

    4 h-index

    7 publications

    853 citations

  5. University of Kragujevac

    Kragujevac, Serbia

    3 h-index

    5 publications

    192 citations

  6. Centre National de la Recherche Scientifique

    Paris, France

    3 h-index

    11 publications

    533 citations

  7. University of the Witwatersrand

    Johannesburg, South Africa

    3 h-index

    11 publications

    439 citations

  8. University of Vienna

    Vienna, Austria

    3 h-index

    7 publications

    214 citations

1–8 of 374

Venues

  1. Journal of the American Chemical Society

    JACS · 42 publications · 2.6K citations

    29

    h-index

  2. 16

    h-index

  3. Journal of Medicinal Chemistry

    14 publications · 1.7K citations

    14

    h-index

  4. PubMed

    Repository · 12 publications · 427 citations

    12

    h-index

  5. The Journal of Organic Chemistry

    JOC · 11 publications · 346 citations

    11

    h-index

1–5