Search Result "Huckel method"
Structures and Stabilities: Quantum-Chemical Study of Aun (n = 2-2016) Nanoclusters by Extended Huckel and DFT Approaches
Journal: Nanoscience & Nanotechnology-Asia
Volume: 2 Issue: 1 Year: 2012 Page: 2-10
Author(s): Bakhtiyor Rasulev,Marquita Watkins,Melissa Theodore,Joany Jackman,Jerzy Leszczynski
How Can We Explain the Stability of Conjugated Hydrocarbon- and Heterosubstituted Networks by Topological Descriptors?
Journal: Current Computer-Aided Drug Design
Volume: 6 Issue: 4 Year: 2010 Page: 225-234
Author(s): Haruo Hosoya
Study of Length-Dependent Tunneling Magnetoresistance in Two Phenyl Based Molecules
Journal: Current Physical Chemistry
Volume: 4 Issue: 3 Year: 2014 Page: 285-289
Author(s): S. Ramezani Akbarabadi,Z. Golsanamlou,H. Rahimpour Soleimani
Cross-Conjugation at the Heart of Understanding the Electronic Theory of Organic Chemistry
Journal: Current Organic Chemistry
Volume: 19 Issue: 4 Year: 2015 Page: 293-310
Author(s): Haruo Hosoya
Profiling the Structural Determinants of Heteroarylnitrile Scaffold-Based Derivatives as Falcipain-2 Inhibitors by In Silico Methods
Journal: Current Medicinal Chemistry
Volume: 20 Issue: 1 Year: 2013 Page: 2032-2042
Author(s): Jinghui Wang, Yan Li, Yinfeng Yang, Shuwei Zhang, Ling Yang
Measurements of Thermodynamic Acid Dissociation Constants for Three HMG-CoA Reductase Inhibitors by using RPLC and Study of Validation in Pharmaceutical Tablets
Journal: Current Pharmaceutical Analysis
Volume: 13 Issue: 1 Year: 2017 Page: 48-55
Author(s): Vesile Canseven,Ebru Cubuk Demiralay,Zehra Ustun,Y. Dogan Daldal,Sibel A. Ozkan,Guleren Alsancak
3D-QSAR and Molecular Docking Studies of Pyrazole Derivatives as Inhibitors of Enoyl Acyl Carrier Protein Reductase from Mycobacterium tuberculosis
Journal: Letters in Drug Design & Discovery
Volume: 14 Issue: 4 Year: 2017 Page: 414-433
Author(s): Sheshagiri R. Dixit,Shrinivas D. Joshi,V. H. Kulkarni,Tejraj M. Aminabhavi
In-Silico Analysis of Electronic Structures of Model Polypeptide Chains using Particle Swarm Optimization
Journal: Current Physical Chemistry
Volume: 6 Issue: 4 Year: 2016 Page: 297-306
Author(s): Priyanka Thakral,Vimal Rarh,Ashok K. Bakhshi
QSAR Analysis and Molecular Docking Studies of Aryl Sulfonamide Derivatives as Mcl-1 Inhibitors and the Influence of Structure and Chirality on the Inhibitory Activity
Journal: Letters in Drug Design & Discovery
Volume: 21 Issue: 16 Year: 2024 Page: 3465-3478
Author(s):
Ag+-selective poly(vinyl chloride) Membrane Electrode Based on [N,N- ethylenebis-(3-methoxy salicylaldimine)]
Journal: Current Analytical Chemistry
Volume: 7 Issue: 2 Year: 2011 Page: 136-145
Author(s): C. Topcu, F. Coldur, M. Andac, I. Isildak, N. Senyuz, H. Bati