Search Result "orbital shift"


Localization and Localizability in Quantum Organic Chemistry: Localized Orbitals and Localization Functions

Journal: Current Organic Chemistry
Volume: 15 Issue: 2 Year: 2011 Page: 3555-3565
Author(s): Bernard Silvi, Peter Reinhardt

Band Assignment in Hemoglobin Porphyrin Ring Spectrum: Using Four-Orbital Model of Gouterman

Journal: Protein & Peptide Letters
Volume: 17 Issue: 4 Year: 2010 Page: 473-479
Author(s): Mohammad Reza Dayer, Ali Akbar Moosavi-Movahedi, Mohammad Saaid Dayer

Prediction of Thermal Isomerization Temperatures of Substituted Benzocyclobutenes to o-Quinodimethanes by Semi-Empirical Molecular Orbital Calculation

Journal: Letters in Organic Chemistry
Volume: 8 Issue: 2 Year: 2011 Page: 138-142
Author(s): Keisuke Chino, Takeshi Endo

New Concepts of Deployable De-Orbit and Re-Entry Systems for CubeSat Miniaturized Satellites

Journal: Recent Patents on Engineering
Volume: 8 Issue: 1 Year: 2014 Page: 2-12
Author(s): Valerio Carandente,Raffaele Savino

Intramolecular Electron Transfer: Computational Study Based on the Orbital Deletion Procedure (ODP)

Journal: Current Organic Chemistry
Volume: 10 Issue: 7 Year: 2006 Page: 779-790
Author(s): Yirong Mo

77Se NMR: Theoretical Aspects and Practical Applications

Ebook: Organoselenium Chemistry: Between Synthesis and Biochemistry
Volume: 1 Year: 2014
Author(s): Waro Nakanishi,Satoko Hayashi
Doi: 10.2174/9781608058389114010016

Attentional Set-Shifting in Rodents: A Review of Behavioural Methods and Pharmacological Results

Journal: Current Pharmaceutical Design
Volume: 20 Issue: 3 Year: 2014 Page: 5046-5059
Author(s): David S. Tait, E. Alexander Chase, Verity J. Brown

Ceria-Based Materials for Hydrogen Production Via Hydrocarbon Steam Reforming and Water-Gas Shift Reactions

Journal: Recent Patents on Materials Science
Volume: 4 Issue: 2 Year: 2011 Page: 122-145
Author(s): Kyriaki Polychronopoulou, Christos M. Kalamaras, Angelos M. Efstathiou

On the Paradigm Shift Towards Multitarget Selective Drug Design

Journal: Current Computer-Aided Drug Design
Volume: 4 Issue: 2 Year: 2008 Page: 76-90
Author(s): Nigus Dessalew, Workalemahu Mikre

aza-Michael Addition of Primary Amines by Lipases and Microwave Irradiation: A Green Protocol for the Synthesis of Propanenitrile Derivatives

Journal: Current Microwave Chemistry
Volume: 1 Issue: 2 Year: 2014 Page: 87-93
Author(s): Yara Jaqueline Kerber Araujo,Andre Luiz Meleiro Porto

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