Aceclofenac and interactions analysis in the crystal and COX protein active site
Authors:
- Christian JelschCJChristian Jelsch
- Rajendran Niranjana DeviRDRajendran Niranjana Devi
- Bruce C. NollBNBruce C. Noll
- Benoît GuillotBGBenoît Guillot
- Israel SamuelISIsrael Samuel
- Emmanuel AubertEAEmmanuel Aubert
- 1 April 2020
- journal article
- research article
- Published by Elsevier in Journal of Molecular Structure
- Vol. 1205
Abstract
No abstract availableKeywords
This publication has 45 references indexed in Scilit:
- Topological Electron Density Analysis and Electrostatic Properties of Aspirin: An Experimental and Theoretical StudyCrystal Growth & Design, 2012
- Preparation and characterization of aceclofenac microspheresAsian Journal of Pharmaceutics, 2008
- Basis Set Exchange: A Community Database for Computational SciencesJournal of Chemical Information and Modeling, 2007
- An overview of halogen bondingJournal of Molecular Modeling, 2006
- The Protein Data BankNucleic Acids Research, 2000
- Relativistic X-ray Elastic Scattering Factors for Neutral AtomsZ= 1–54 from Multiconfiguration Dirac–Fock Wavefunctions in the 0–12Å−1sinθ /λ Range, and Six-Gaussian Analytical Expressions in the 0–6Å−1RangeActa Crystallographica Section A Foundations of Crystallography, 1997
- The role of databases in support of computational chemistry calculationsJournal of Computational Chemistry, 1996
- Crystal structure and spectroscopic study of 2-[(2,6-dichlorophenyl)amino]phenylacetoxyacetic acid (Aceclofenac)Journal of Chemical Crystallography, 1992
- Synthesis and quantitative structure-activity relationships of diclofenac analogsJournal of Medicinal Chemistry, 1990
- The Anharmonic Temperature Factor in Crystallographic Structure AnalysisAustralian Journal of Physics, 1988