Search Result "Aug-cc-pVTZ-J"

On the Use of Locally Dense Basis Sets in the Calculation of EPR Hyperfine Couplings: A Study on Model Systems for Bio-Inorganic Fe and Co Complexes

Journal: Current Inorganic Chemistry (Discontinued)
Volume: 3 Issue: 3 Year: 2013 Page: 270-283
Author(s): Birgitte O. Milhoj,Erik D. Hedegard,Stephan P. A. Sauer

Optimizing the Structure of Tetracyanoplatinate (II): A Comparison of Relativistic Density Functional Theory Methods

Journal: Current Inorganic Chemistry (Discontinued)
Volume: 3 Issue: 3 Year: 2013 Page: 213-219
Author(s): Asmus O. Dohn,Klaus B. Moller,Stephan P. A. Sauer

Generation, Identification, and Synthetic Applications of Nitrile Sulfides and Nitrile Selenides

Journal: Current Organic Chemistry
Volume: 15 Issue: 1 Year: 2011 Page: 1734-1744
Author(s): Melinda Krebsz, Tibor Pasinszki

The Synthesis, Reactivity and NMR Investigation on 15N-Thiophosphoramidates (Supplementary Material)

Journal: Letters in Organic Chemistry
Volume: 6 Issue: 8 Year: 2009 Page: 642-647
Author(s): Tomasz Ruman, Karolina Dlugopolska, Agata Jurkiewicz, Dagmara Kramarz, Tomasz Fraczyk, Andrzej Les, Wojciech Rode

Ring Versus Nitrogen Protonation of Anilines

Journal: Letters in Organic Chemistry
Volume: 1 Issue: 1 Year: 2004 Page: 23-30
Author(s): Robert Flammang, Noemie Dechamps, Laurent Pascal, Yves Van Haverbeke, Pascal Gerbaux, Pham-Cam Nam, Minh Tho Nguyen

Chlorine Isotope Effects on Chemical Reactions

Journal: Current Organic Chemistry
Volume: 9 Issue: 1 Year: 2005 Page: 75-88
Author(s): D. Sicinska, M. Rostkowski, P. Paneth

Review Article

Absolute Configuration Determination by Quantum Mechanical Calculation of Chiroptical Spectra: Basics and Applications to Fungal Metabolites

Journal: Current Medicinal Chemistry
Volume: 25 Issue: 2 Year: 2018 Page: 287-320
Author(s): Stefano Superchi,Patrizia Scafato,Marcin Gorecki,Gennaro Pescitelli

Progression of Absolute Configuration Determination in Natural Product Chemistry Using Optical Rotation (Dispersion), Matrix Determinant and Electronic Circular Dichroism Methods

Journal: Current Organic Chemistry
Volume: 15 Issue: 1 Year: 2011 Page: 1843-1862
Author(s): Sheng-Ding Zhao, Lan Shen, Du-Qiang Luo, Hua-Jie Zhu

Theoretical Insights into Dispersion and Hydrogen-Bonding Interactions in Biomolecular Systems

Journal: Current Organic Chemistry
Volume: 14 Issue: 2 Year: 2010 Page: 129-137
Author(s): Alexander Pavlov, Petar M. Mitrasinovic

First Principles Computational Biochemistry with deMon2k

Ebook: Frontiers in Computational Chemistry
Volume: 2 Year: 2015
Author(s): A. Alvarez-Ibarra,P. Calaminici,A. Goursot,C. Z. Gómez-Castro,R. Grande-Aztatzi,T. Mineva,D. R. Salahub,J. M. Vásquez-Pérez,A. Vela,B. Zuniga-Gutierrez,A. M. Köster
Doi: 10.2174/9781608059782115020009

Previous   Next

Go To   Results 1 - 1 of 19

Apply Filters

Volume Years
Article Type
    Publication Title
      Subject Title

Content Type


© 2024 Bentham Science Publishers | Privacy Policy