Protein−Ligand Docking against Non-Native Protein Conformers

Article Properties
  • Language
    English
  • DOI (url)
  • Publication Date
    2008/10/28
  • Indian UGC (journal)
  • Refrences
    29
  • Citations
    111
  • Marcel L. Verdonk Astex Therapeutics Ltd., 436 Cambridge Science Park, Milton Road, Cambridge CB4 0QA, United Kingdom
  • Paul N. Mortenson Astex Therapeutics Ltd., 436 Cambridge Science Park, Milton Road, Cambridge CB4 0QA, United Kingdom
  • Richard J. Hall Astex Therapeutics Ltd., 436 Cambridge Science Park, Milton Road, Cambridge CB4 0QA, United Kingdom
  • Michael J. Hartshorn Astex Therapeutics Ltd., 436 Cambridge Science Park, Milton Road, Cambridge CB4 0QA, United Kingdom
  • Christopher W. Murray Astex Therapeutics Ltd., 436 Cambridge Science Park, Milton Road, Cambridge CB4 0QA, United Kingdom
Cite
Verdonk, Marcel L., et al. “Protein−Ligand Docking Against Non-Native Protein Conformers”. Journal of Chemical Information and Modeling, vol. 48, no. 11, 2008, pp. 2214-25, https://doi.org/10.1021/ci8002254.
Verdonk, M. L., Mortenson, P. N., Hall, R. J., Hartshorn, M. J., & Murray, C. W. (2008). Protein−Ligand Docking against Non-Native Protein Conformers. Journal of Chemical Information and Modeling, 48(11), 2214-2225. https://doi.org/10.1021/ci8002254
Verdonk, Marcel L., Paul N. Mortenson, Richard J. Hall, Michael J. Hartshorn, and Christopher W. Murray. “Protein−Ligand Docking Against Non-Native Protein Conformers”. Journal of Chemical Information and Modeling 48, no. 11 (2008): 2214-25. https://doi.org/10.1021/ci8002254.
Verdonk ML, Mortenson PN, Hall RJ, Hartshorn MJ, Murray CW. Protein−Ligand Docking against Non-Native Protein Conformers. Journal of Chemical Information and Modeling. 2008;48(11):2214-25.
Refrences
Title Journal Journal Categories Citations Publication Date
A new method for ligand docking to flexible receptors by dual alanine scanning and refinement (SCARE) Journal of Computer-Aided Molecular Design
  • Science: Biology (General)
  • Science: Biology (General)
  • Science: Physics
  • Science: Mathematics: Instruments and machines: Electronic computers. Computer science
  • Science: Chemistry: Analytical chemistry
  • Science: Chemistry
60 2008
FLIPDock: Docking flexible ligands into flexible receptors

Proteins: Structure, Function, and Bioinformatics
  • Science: Biology (General)
  • Science: Biology (General)
  • Science: Physics
  • Science: Biology (General)
  • Science: Chemistry: Organic chemistry: Biochemistry
  • Science: Biology (General)
  • Science: Chemistry: Organic chemistry: Biochemistry
66 2007
Diverse, High-Quality Test Set for the Validation of Protein−Ligand Docking Performance Journal of Medicinal Chemistry
  • Medicine: Therapeutics. Pharmacology
  • Science: Chemistry: Analytical chemistry
  • Science: Chemistry
433 2007
A Flexible Approach to Induced Fit Docking Journal of Medicinal Chemistry
  • Medicine: Therapeutics. Pharmacology
  • Science: Chemistry: Analytical chemistry
  • Science: Chemistry
114 2007
Docking Ligands into Flexible and Solvated Macromolecules. 1. Development and Validation of FITTED 1.0 Journal of Chemical Information and Modeling
  • Medicine: Therapeutics. Pharmacology
  • Science: Chemistry: General. Including alchemy
  • Science: Science (General): Cybernetics: Information theory
  • Science: Mathematics: Instruments and machines: Electronic computers. Computer science
  • Science: Chemistry
130 2007
Refrences Analysis
The category Science: Biology (General) 17 is the most frequently represented among the references in this article. It primarily includes studies from Journal of Molecular Biology and Journal of Medicinal Chemistry. The chart below illustrates the number of referenced publications per year.
Refrences used by this article by year
Citations
Title Journal Journal Categories Citations Publication Date
Quantitative clustering and matching of conformers using average electron densities Arabian Journal of Chemistry
  • Science: Chemistry
  • Science: Chemistry: General. Including alchemy
  • Science: Chemistry
2024
Docking, synthesis, and anticancer assessment of novel quinoline-amidrazone hybrids

Pharmacia
  • Medicine: Pharmacy and materia medica
  • Medicine: Therapeutics. Pharmacology
2024
Benchmarking applicability of medium‐resolution cryo‐EM protein structures for structure‐based drug design

Journal of Computational Chemistry
  • Science: Chemistry: General. Including alchemy
  • Science: Chemistry
1 2023
Design, synthesis, biological evaluation and crystal structure determination of dual modulators of carbonic anhydrases and estrogen receptors European Journal of Medicinal Chemistry
  • Medicine: Therapeutics. Pharmacology
  • Science: Chemistry: Analytical chemistry
  • Science: Chemistry
4 2023
Novel Sulfonamide–Triazine Hybrid Derivatives: Docking, Synthesis, and Biological Evaluation as Anticancer Agents ACS Omega
  • Science: Chemistry
  • Science: Chemistry: General. Including alchemy
  • Science: Chemistry
8 2023
Citations Analysis
Category Category Repetition
Science: Chemistry73
Science: Mathematics: Instruments and machines: Electronic computers. Computer science58
Medicine: Therapeutics. Pharmacology54
Science: Chemistry: General. Including alchemy50
Science: Biology (General)43
Science: Science (General): Cybernetics: Information theory35
Science: Chemistry: Analytical chemistry28
Science: Physics18
Science: Chemistry: Organic chemistry: Biochemistry14
Medicine: Public aspects of medicine: Toxicology. Poisons11
Medicine: Medicine (General): Computer applications to medicine. Medical informatics10
Science: Science (General)4
Medicine3
Medicine: Medicine (General)3
Science: Chemistry: Organic chemistry3
Science: Chemistry: Physical and theoretical chemistry3
Science: Physics: Atomic physics. Constitution and properties of matter3
Technology: Chemical technology: Biotechnology2
Science: Biology (General): Genetics2
Science2
Technology: Technology (General): Industrial engineering. Management engineering: Information technology2
Science: Biology (General): Cytology2
Medicine: Internal medicine: Specialties of internal medicine: Diseases of the endocrine glands. Clinical endocrinology2
Technology: Electrical engineering. Electronics. Nuclear engineering: Telecommunication1
Science: Microbiology1
Medicine: Pharmacy and materia medica1
Medicine: Internal medicine: Neurosciences. Biological psychiatry. Neuropsychiatry1
Science: Chemistry: Crystallography1
Medicine: Internal medicine: Neoplasms. Tumors. Oncology. Including cancer and carcinogens1
The category Science: Chemistry 73 is the most commonly referenced area in studies that cite this article. The first research to cite this article was titled Recipes for the Selection of Experimental Protein Conformations for Virtual Screening and was published in 2009. The most recent citation comes from a 2024 study titled Quantitative clustering and matching of conformers using average electron densities. This article reached its peak citation in 2012, with 13 citations. It has been cited in 48 different journals, 22% of which are open access. Among related journals, the Journal of Chemical Information and Modeling cited this research the most, with 33 citations. The chart below illustrates the annual citation trends for this article.
Citations used this article by year