Concepedia

Conformer Population Analysis

Conformer Population Analysis is a computational method in conformational analysis that quantitatively determines the relative abundances of distinct conformers in a dynamic equilibrium based on their thermodynamic stabilities and spectroscopic observables.

155

Publications

5.4K

Citations

538

Authors

228

Institutions

Publications per year

2017–2026

19

Parents

Publications

155

Conformer populations of l-iduronic acid residues in glycosaminoglycan sequences

Dino R. Ferro, Augusto Provasoli, Massimo Ragazzi et al. · Carbohydrate Research · 1990 · 238 citations

, , +14

Estimation of changes in side chain configurational entropy in binding and folding: General methods and application to helix formation

Kon Ho Lee, Dong Xie, Ernesto Freire et al. · Proteins Structure Function and Bioinformatics · 1994 · 222 citations

, , +17

Monte Carlo vs Molecular Dynamics for Conformational Sampling

William L. Jorgensen, Julian Tirado‐Rives · The Journal of Physical Chemistry · 1996 · 172 citations

, , +13

Comparison of conformer distributions in the crystalline state with conformational energies calculated by ab initio techniques

Frank H. Allen, Stephanie E. Harris, Robin Taylor · Journal of Computer-Aided Molecular Design · 1996 · 109 citations

, , +17

Conformation of Alkanes in the Gas Phase and Pure Liquids

Laura L. Thomas, Theodore J. Christakis, William L. Jorgensen · The Journal of Physical Chemistry B · 2006 · 105 citations

, , +17

1–5 of 155

Authors

538

  1. PB
    Petr Bouř

    Czech Academy of Sciences, Institute of Organic Chemistry and Biochemistry, Czechia

    6 publications · 199 citations

    6

    h-index

  2. RJ
    Raymond J. Abraham

    University of Liverpool, United Kingdom

    6 publications · 147 citations

    6

    h-index

  3. JK
    Josef Kapitán

    Czech Academy of Sciences, Institute of Organic Chemistry and Biochemistry, Czechia

    4 publications · 112 citations

    4

    h-index

  4. CR
    Clark R. Landis

    University of Wisconsin–Madison, United States

    4 publications · 157 citations

    4

    h-index

  5. DC
    David C. Clary

    University of Cambridge, United Kingdom

    3 publications · 97 citations

    3

    h-index

1–5 of 538

Institutions

228

  1. Czech Academy of Sciences, Institute of Organic Chemistry and Biochemistry

    Prague, Czechia

    7 h-index

    23 publications

    774 citations

  2. Yale University

    New Haven, United States

    5 h-index

    11 publications

    965 citations

  3. Centre National de la Recherche Scientifique

    Paris, France

    4 h-index

    17 publications

    622 citations

  4. University of Wisconsin–Madison

    Madison, United States

    4 h-index

    14 publications

    532 citations

  5. Charles University

    Prague, Czechia

    4 h-index

    10 publications

    419 citations

  6. University of Warsaw

    Warsaw, Poland

    4 h-index

    5 publications

    184 citations

  7. Indian Institute of Science Bangalore

    Bengaluru, India

    4 h-index

    9 publications

    110 citations

  8. University of Liverpool

    Liverpool, United Kingdom

    3 h-index

    6 publications

    112 citations

1–8 of 228

Venues

  1. The Journal of Physical Chemistry B

    14 publications · 658 citations

    12

    h-index

  2. The Journal of Physical Chemistry A

    12 publications · 395 citations

    11

    h-index

  3. Journal of the American Chemical Society

    JACS · 8 publications · 395 citations

    8

    h-index

  4. The Journal of Chemical Physics

    7 publications · 271 citations

    7

    h-index

  5. 7

    h-index

1–5