DFT investigation of the solid-state properties and Hirshfeld surface analysis of antidiabetic drugs: Acetohexamide and Tolazamide
Published 2023 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
DFT investigation of the solid-state properties and Hirshfeld surface analysis of antidiabetic drugs: Acetohexamide and Tolazamide
Authors
Keywords
-
Journal
CHEMICAL PHYSICS LETTERS
Volume -, Issue -, Pages 140934
Publisher
Elsevier BV
Online
2023-11-03
DOI
10.1016/j.cplett.2023.140934
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Novel two-dimensional Janus YMN (M= I, Br and N= Cl, Br) monolayers
- (2023) C. Tayran et al. MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING
- Experimental Raman, FTIR and UV-Vis Spectra, DFT Studies of Molecular Structures and Barrier Heights, Thermodynamic Functions and Bioactivity of Kaempferol
- (2022) Bhoopendra Yadav et al. JOURNAL OF MOLECULAR STRUCTURE
- Crystal Engineering of Pharmaceutical Cocrystals in the Discovery and Development of Improved Drugs
- (2022) Geetha Bolla et al. CHEMICAL REVIEWS
- Management of Hyperglycemia in Type 2 Diabetes, 2022. A Consensus Report by the American Diabetes Association (ADA) and the European Association for the Study of Diabetes (EASD)
- (2022) Melanie J. Davies et al. DIABETES CARE
- CrystalExplorer: a program for Hirshfeld surface analysis, visualization and quantitative analysis of molecular crystals
- (2021) Peter R. Spackman et al. JOURNAL OF APPLIED CRYSTALLOGRAPHY
- First-principles study of solid-state properties of adrenergic neurotransmitters, orthorhombic noradrenaline, and monoclinic adrenaline
- (2021) R. L. Araújo et al. JOURNAL OF APPLIED PHYSICS
- Engineering the hydrogen storage properties of the perovskite hydride ZrNiH3 by uniaxial/biaxial strain
- (2021) M. Rkhis et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Structural, spectroscopic, physical properties and quantum chemical investigation on bromide salt of 4-dimethylaminopyridine NLO material for optoelectronic applications
- (2020) G. Sivaraj et al. JOURNAL OF MOLECULAR STRUCTURE
- Insights into solid-state properties of dopamine and L-Dopa hydrochloride crystals through DFT calculations
- (2020) R.L. Araújo et al. CHEMICAL PHYSICS LETTERS
- Single Crystal X-Ray Structural Analysis of Two Polymorphs of Ethyl 2-(2-Chlorophenyl)-4-Hydroxy-5-Oxo-1-Phenyl-2,5-Dihydro-1H-Pyrrole-3-Carboxylate
- (2019) A. Ramazani et al. JOURNAL OF STRUCTURAL CHEMISTRY
- Completing the picture of tolazamide polymorphism under extreme conditions: a low-temperature study
- (2019) Alexey Yu. Fedorov et al. Acta Crystallographica Section C-Structural Chemistry
- The comorbidity burden of type 2 diabetes mellitus: patterns, clusters and predictions from a large English primary care cohort
- (2019) Magdalena Nowakowska et al. BMC Medicine
- Qualitative as well as quantitative analysis of interactions present in chlorine and bromine substituted aromatic organic crystals: A DFT linked Crystal Explorer study
- (2019) Mayank Khera et al. JOURNAL OF MOLECULAR GRAPHICS & MODELLING
- Thermoelectric properties of InN graphene-like nanosheet: A first principle study
- (2019) M. Yeganeh et al. SUPERLATTICES AND MICROSTRUCTURES
- DFT calculations of the structural, electronic, optical and vibrational properties of anhydrous orthorhombic L-threonine crystals
- (2019) Roniel L. Araújo et al. Computational and Theoretical Chemistry
- Core–Shell Microneedle Gel for Self-Regulated Insulin Delivery
- (2018) Jinqiang Wang et al. ACS Nano
- Structural, elastic, electronic, phonon, dielectric and optical properties of Bi 3 TeBO 9 from first-principles calculations
- (2018) Mi Zhong et al. JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS
- Electronic and optical properties of V doped AlN nanosheet: DFT calculations
- (2018) Sahar Javaheri et al. CHINESE JOURNAL OF PHYSICS
- Microstructure, fractal geometry and dye-sensitized solar cells performance of CdS/TiO2 nanostructures
- (2018) Tahereh Hoseinzadeh et al. JOURNAL OF ELECTROANALYTICAL CHEMISTRY
- Molecular Adducts of Isoniazid: Crystal Structure, Electronic Properties, and Hirshfeld Surface Analysis
- (2018) A. S. Kamalakaran JOURNAL OF STRUCTURAL CHEMISTRY
- Synthesis of multiwalled carbon nanotubes on Cu-Fe nano-catalyst substrate
- (2017) Sahar Rezaee et al. Results in Physics
- A new polymorph of metacetamol
- (2015) Lindsay McGregor et al. CRYSTENGCOMM
- Theoretical and experimental investigations on vibrational and structural properties of tolazamide
- (2015) Mustafa Karakaya et al. JOURNAL OF MOLECULAR STRUCTURE
- Sulfonylureas: A New Look at Old Therapy
- (2014) Peter M. Thulé et al. Current Diabetes Reports
- Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenidesMoS2,MoSe2,WS2, andWSe2
- (2014) Jiangang He et al. PHYSICAL REVIEW B
- Conformational Polymorphism
- (2013) Aurora J. Cruz-Cabeza et al. CHEMICAL REVIEWS
- Hyperglycemia-induced Oxidative Stress and its Role in Diabetes Mellitus Related Cardiovascular Diseases
- (2013) Teresa Fiorentino et al. CURRENT PHARMACEUTICAL DESIGN
- Crystallization of a new polymorph of acetohexamide from 2-hydroxybutyl-β-cyclodextrin solution: Form VI with a high aqueous solubility
- (2013) Hibah Aldawsari et al. INTERNATIONAL JOURNAL OF PHARMACEUTICS
- Cell signalling in insulin secretion: the molecular targets of ATP, cAMP and sulfonylurea
- (2012) S. Seino DIABETOLOGIA
- Conformational polymorphism of the antidiabetic drug chlorpropamide
- (2011) A. P. Ayala et al. JOURNAL OF RAMAN SPECTROSCOPY
- Theoretical studies on the structural, electronic, and optical properties of Cu2CdGeSe4
- (2011) Dan Li et al. PHYSICA B-CONDENSED MATTER
- Synthesis, molecular conformation, vibrational and electronic transition, isometric chemical shift, polarizability and hyperpolarizability analysis of 3-(4-Methoxy-phenyl)-2-(4-nitro-phenyl)-acrylonitrile: A combined experimental and theoretical analysis
- (2011) Abdullah Mohamed Asiri et al. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
- Conformational Polymorphism in Sulfonylurea Drugs: Electronic Structure Analysis
- (2010) Yoganjaneyulu Kasetti et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Spectroscopic investigations and quantum chemical computational study of (E)-4-methoxy-2-[(p-tolylimino)methyl]phenol
- (2010) Basak Kosar et al. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
- Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential
- (2009) Fabien Tran et al. PHYSICAL REVIEW LETTERS
- Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data
- (2009) Alexandre Tkatchenko et al. PHYSICAL REVIEW LETTERS
- The Effect of Sulphonylureas on the Microvascular and Macrovascular Complications of Diabetes
- (2008) Partha Kar et al. CARDIOVASCULAR DRUGS AND THERAPY
- Hirshfeld surface analysis
- (2008) Mark A. Spackman et al. CRYSTENGCOMM
- Theoretical study of molecular structure, pKa, lipophilicity, solubility, absorption, and polar surface area of some hypoglycemic agents
- (2008) Milan Remko JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
- Gene therapy for type 1 diabetes mellitus in rats by gastrointestinal administration of chitosan nanoparticles containing human insulin gene
- (2008) Li Niu et al. WORLD JOURNAL OF GASTROENTEROLOGY
Find Funding. Review Successful Grants.
Explore over 25,000 new funding opportunities and over 6,000,000 successful grants.
ExploreBecome a Peeref-certified reviewer
The Peeref Institute provides free reviewer training that teaches the core competencies of the academic peer review process.
Get Started