Molecular Recognition of Azelaic Acid and Related Molecules with DNA Polymerase I Investigated by Molecular Modeling Calculations
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Title
Molecular Recognition of Azelaic Acid and Related Molecules with DNA Polymerase I Investigated by Molecular Modeling Calculations
Authors
Keywords
Rational drug design, Azelaic acid, Acne, DNA polymerase I, Density functional theory, Nonbonding interactions, Molecular docking
Journal
Interdisciplinary Sciences-Computational Life Sciences
Volume 10, Issue 3, Pages 525-537
Publisher
Springer Nature
Online
2016-10-01
DOI
10.1007/s12539-016-0186-3
References
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Note: Only part of the references are listed.- Impacts of Nonsynonymous Single Nucleotide Polymorphisms of Adiponectin Receptor 1 Gene on Corresponding Protein Stability: A Computational Approach
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- Molecular Recognition in Chemical and Biological Systems
- (2015) Elke Persch et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Applications of Fluorine in Medicinal Chemistry
- (2015) Eric P. Gillis et al. JOURNAL OF MEDICINAL CHEMISTRY
- A questionable excited-state double-proton transfer mechanism for 3-hydroxyisoquinoline
- (2015) Jinfeng Zhao et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Competitive excited-state single or double proton transfer mechanisms for bis-2,5-(2-benzoxazolyl)-hydroquinone and its derivatives
- (2015) Jinfeng Zhao et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- References
- (2013) M. Schmid et al. CYTOGENETIC AND GENOME RESEARCH
- Synthesis and structural insights of substituted 2-iodoacetanilides and 2-iodoanilines
- (2013) Mohammad Mazharol Hoque et al. JOURNAL OF MOLECULAR STRUCTURE
- Trifluoromethylation of Aryl and Heteroaryl Halides with Fluoroform-Derived CuCF3: Scope, Limitations, and Mechanistic Features
- (2013) Anton Lishchynskyi et al. JOURNAL OF ORGANIC CHEMISTRY
- Amplified Halogen Bonding in a Small Space
- (2013) Mohammed G. Sarwar et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Water Networks Contribute to Enthalpy/Entropy Compensation in Protein–Ligand Binding
- (2013) Benjamin Breiten et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Molecular recognition using corona phase complexes made of synthetic polymers adsorbed on carbon nanotubes
- (2013) Jingqing Zhang et al. Nature Nanotechnology
- Epidemiology of acne vulgaris
- (2012) K. Bhate et al. BRITISH JOURNAL OF DERMATOLOGY
- Halogen bonding in solution: thermodynamics and applications
- (2012) Thomas M. Beale et al. CHEMICAL SOCIETY REVIEWS
- Halogen Bonding between Anions and Iodoperfluoroorganics: Solution-Phase Thermodynamics and Multidentate-Receptor Design
- (2012) Mohammed G. Sarwar et al. CHEMISTRY-A EUROPEAN JOURNAL
- Thermodynamic studies for drug design and screening
- (2012) Nichola C Garbett et al. Expert Opinion on Drug Discovery
- Halogen bonding for rational drug design and new drug discovery
- (2012) Yunxiang Lu et al. Expert Opinion on Drug Discovery
- admetSAR: A Comprehensive Source and Free Tool for Assessment of Chemical ADMET Properties
- (2012) Feixiong Cheng et al. Journal of Chemical Information and Modeling
- Hydrogen Bonding in the Electronic Excited State
- (2011) Guang-Jiu Zhao et al. ACCOUNTS OF CHEMICAL RESEARCH
- Application of the Hard and Soft, Acids and Bases (HSAB) Theory to Toxicant–Target Interactions
- (2011) Richard M. LoPachin et al. CHEMICAL RESEARCH IN TOXICOLOGY
- LigPlot+: Multiple Ligand–Protein Interaction Diagrams for Drug Discovery
- (2011) Roman A. Laskowski et al. Journal of Chemical Information and Modeling
- Acne vulgaris
- (2011) Hywel C Williams et al. LANCET
- Catalysis for fluorination and trifluoromethylation
- (2011) Takeru Furuya et al. NATURE
- Innate C-H trifluoromethylation of heterocycles
- (2011) Y. Ji et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- A Tridentate Halogen-Bonding Receptor for Tight Binding of Halide Anions
- (2010) Mohammed G. Sarwar et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- A Medicinal Chemist’s Guide to Molecular Interactions
- (2010) Caterina Bissantz et al. JOURNAL OF MEDICINAL CHEMISTRY
- Thermodynamics of Halogen Bonding in Solution: Substituent, Structural, and Solvent Effects
- (2010) Mohammed G. Sarwar et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Macroscopic self-assembly through molecular recognition
- (2010) Akira Harada et al. Nature Chemistry
- Fluorine in medicinal chemistry: a century of progress and a 60-year retrospective of selected highlights
- (2009) Robert Filler et al. Future Medicinal Chemistry
- Scoring systems in acne vulgaris
- (2009) DevinderMohan Thappa et al. Indian Journal of Dermatology Venereology & Leprology
- QM/MM Calculations in Drug Discovery: A Useful Method for Studying Binding Phenomena?
- (2009) M. Paul Gleeson et al. Journal of Chemical Information and Modeling
- AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading
- (2009) Oleg Trott et al. JOURNAL OF COMPUTATIONAL CHEMISTRY
- Acne and Systemic Disease
- (2009) Margarita S. Lolis et al. MEDICAL CLINICS OF NORTH AMERICA
- Trifluoromethyl ethers – synthesis and properties of an unusual substituent
- (2008) Frédéric R Leroux et al. Beilstein Journal of Organic Chemistry
- Effects of Hydrogen Bonding on Tuning Photochemistry: Concerted Hydrogen-Bond Strengthening and Weakening
- (2008) Guang-Jiu Zhao et al. CHEMPHYSCHEM
- Acne is Not Associated with Yet-Uncultured Bacteria
- (2008) M. Bek-Thomsen et al. JOURNAL OF CLINICAL MICROBIOLOGY
- Site-Specific Solvation of the Photoexcited Protochlorophyllide a in Methanol: Formation of the Hydrogen-Bonded Intermediate State Induced by Hydrogen-Bond Strengthening
- (2007) Guang-Jiu Zhao et al. BIOPHYSICAL JOURNAL
- Fluorine in medicinal chemistry
- (2007) Sophie Purser et al. CHEMICAL SOCIETY REVIEWS
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