Concepedia

Property Space Mapping

Property Space Mapping is a methodological framework within chemical space analysis that systematically projects molecular structures into a multidimensional property space to enable the quantification and prediction of structure–property relationships.

57

Publications

8.4K

Citations

234

Authors

100

Institutions

Publications per year

2017–2026

29

Parents

Publications

57

Comparative Politics and the Comparative Method

Arend Lijphart · American Political Science Review · 1971 · 3.1K citations

, , +10

Property Distributions:  Differences between Drugs, Natural Products, and Molecules from Combinatorial Chemistry

Miklós Fehér, Jonathan M. Schmidt · Journal of Chemical Information and Computer Sciences · 2002 · 921 citations

, , +16

Data-Driven Review of Thermoelectric Materials: Performance and Resource Considerations

Michael W. Gaultois, Taylor D. Sparks, Christopher K. H. Borg et al. · Chemistry of Materials · 2013 · 492 citations · Full text

, , +16

Defining Desirable Central Nervous System Drug Space through the Alignment of Molecular Properties, in Vitro ADME, and Safety Attributes

Travis T. Wager, Ramalakshmi Y. Chandrasekaran, Xinjun Hou et al. · ACS Chemical Neuroscience · 2010 · 483 citations

, , +16

Chemography:  The Art of Navigating in Chemical Space

Tudor I. Oprea, Johan Gottfries · Journal of Combinatorial Chemistry · 2001 · 359 citations

, , +17

1–5 of 57

Authors

234

  1. PF
    Pascal Friederich

    Karlsruhe Institute of Technology, Germany

    3 publications · 350 citations

    4

    h-index

  2. RP
    Robert Pollice

    University of Toronto, Canada

    3 publications · 350 citations

    3

    h-index

  3. GD
    Gabriel dos Passos Gomes

    Florida State University, United States

    3 publications · 350 citations

    3

    h-index

  4. TG
    Tobias Gensch

    University of Münster, Germany

    3 publications · 350 citations

    3

    h-index

  5. AA
    Alán Aspuru‐Guzik

    Harvard University, United States

    3 publications · 350 citations

    3

    h-index

1–5 of 234

Institutions

100

  1. Karlsruhe Institute of Technology

    Karlsruhe, Germany

    5 h-index

    7 publications

    586 citations

  2. IBM Research - Zurich

    Rüschlikon, Switzerland

    3 h-index

    3 publications

    350 citations

  3. Technische Universität Berlin

    Berlin, Germany

    3 h-index

    3 publications

    350 citations

  4. Vector Institute

    Toronto, Canada

    3 h-index

    4 publications

    671 citations

  5. University of Toronto

    Toronto, Canada

    3 h-index

    22 publications

    2.8K citations

  6. Leiden University

    Leiden, The Netherlands

    3 h-index

    5 publications

    3.6K citations

  7. AstraZeneca (United Kingdom)

    Cambridge, United Kingdom

    3 h-index

    3 publications

    350 citations

  8. Centre National de la Recherche Scientifique

    Paris, France

    3 h-index

    8 publications

    235 citations

1–8 of 100

Venues

  1. ChemRxiv

    Repository · 3 publications · 48 citations

    3

    h-index

  2. Journal of Chemical Information and Modeling

    JCIM · 3 publications · 91 citations

    3

    h-index

  3. Journal of Medicinal Chemistry

    3 publications · 317 citations

    3

    h-index

  4. Advanced Engineering Materials

    1 publications · 59 citations

    2

    h-index

  5. Journal of Computer-Aided Molecular Design

    2 publications · 51 citations

    2

    h-index

1–5