Search Result "quantum chemical parameters"


Development of Quantitative Structure-Activity Relationship for a Set of Carbonic Anhydrase Inhibitors: Use of Quantum and Chemical Descriptors

Journal: Letters in Drug Design & Discovery
Volume: 3 Issue: 9 Year: 2006 Page: 622-635
Author(s): Padmakar V. Khadikar, Omar Deeb, Amal Jaber, Jyoti Singh, Vijay K. Agrawal, Shalini Singh, Meenakshi Lakhwani

Research Article

Formation of a Toxic Quinoneimine Metabolite from Diclofenac: A Quantum Chemical Study

Journal: Drug Metabolism Letters
Volume: 13 Issue: 1 Year: 2019 Page: 64-76
Author(s): Muthusamy Ramesh,Prasad V. Bharatam

Quantum Chemical Studies of the Ground States of the Metal Centres in Haem-Copper Oxidases

Journal: Current Inorganic Chemistry
Volume: 2 Issue: 3 Year: 2012 Page: 316-324
Author(s): Mikael P. Johansson

Review Article

Silicon Quantum Dots: Chemical, Physical Synthesis, and Applications in Fluorescence Detection, Solar Cell, Photocatalyst, and Composite

Journal: Current Nanoscience
Volume: 17 Issue: 0 Year: 2021 Page: 1-21
Author(s): Wanzhe Tong,Qinhong Yin,Dong Fang,Taofang Zeng,Jianhong Yi

Research Article

Application of QSAR Analysis and Different Quantum Chemical Calculation Methods in Activity Evaluation of Selected Fluoroquinolones

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 21 Issue: 7 Year: 2018 Page: 468-475
Author(s): Piotr Kawczak,Leszek Bober,Tomasz Bączek

Quantum Chemical Study of Fe Doped ZnO Nanoclusters

Journal: Micro and Nanosystems
Volume: 5 Issue: 1 Year: 2013 Page: 14-21
Author(s): Shamoon Ahmad Siddiqui, M.M. Abdullah

Size-Controlled Synthesis of CdS Quantum Dots in PVP Matrix

Journal: Micro and Nanosystems
Volume: 4 Issue: 1 Year: 2012 Page: 80-84
Author(s): L. Baruah, S. S. Nath

Quantum Chemical Assessment of the Interaction of Potential Anticorrosion Additives with Steel Surface

Journal: Innovations in Corrosion and Materials Science
Volume: 4 Issue: 2 Year: 2014 Page: 107-117
Author(s): Ime B. Obot

Fluorescence of ZnTe Quantum Dots Prepared Through Chemical Route

Journal: Nanoscience & Nanotechnology-Asia
Volume: 4 Issue: 1 Year: 2014 Page: 45-48
Author(s): Lalit Baruah, Debesh K. Avasthi, Siddhartha S. Nath

Size-dependent Luminescence of Colloidal ZnSe Quantum Dots

Journal: Micro and Nanosystems
Volume: 4 Issue: 3 Year: 2012 Page: 227-230
Author(s): S. C. Dey, S. S. Nath, R. Bhattacherjee

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