Search Result "DFT calculations."


The Role of the exo-Anomeric Effect in the Stereoselective Oxidation of 1- Thioglycosides: A Contribution in the α-D-Glucopyranoside Series Using XRay Crystallography

Journal: Letters in Organic Chemistry
Volume: 1 Issue: 4 Year: 2004 Page: 376-380
Author(s): Maria Chiara Aversa, Anna Barattucci, Paola Bonaccorsi, Giuseppe Bruno, Placido Giannetto, Patrick Rollin

Theoretical Design of Conjugated Organic Polymers

Journal: Current Organic Chemistry
Volume: 8 Issue: 7 Year: 2004 Page: 569-590
Author(s): Ulrike Salzner

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

Iron Chelators in Cancer Chemotherapy

Journal: Current Topics in Medicinal Chemistry
Volume: 4 Issue: 1 Year: 2004 Page: 1623-1635
Author(s): Joan L. Buss, Bryan T. Greene, JoLyn Turner, Frank M. Torti, Suzy V. Torti

6-Oxo-Morphinane Oximes: Pharmacology, Chemistry and Analytical Application

Journal: Current Medicinal Chemistry
Volume: 11 Issue: 1 Year: 2004 Page: 2555-2564
Author(s): A. Gergely, K. Gyimesi-Forras, P. Horvath, S. Hosztafi, J. Kokosi, P. I. Nagy, Gy Szasz, A. Szentesi

Isopolyhalomethanes: Their Formation, Structures, Properties and Cyclopropanation Reactions with Olefins

Journal: Current Organic Chemistry
Volume: 8 Issue: 9 Year: 2004 Page: 739-755
Author(s): D. L. Phillips, W. -H. Fang, X. Zheng, Y. -L. Li, D. Wang, W. M. Kwok

Antitumor Titanium Compounds

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 4 Issue: 1 Year: 2004 Page: 49-60
Author(s): F. Caruso, M. Rossi

SNP Analysis Combined with Protein Structure Prediction Defines Structure- Functional Relationships in Cancer Related Cytochrome P450 Estrogen Metabolism

Journal: Current Medicinal Chemistry
Volume: 11 Issue: 5 Year: 2004 Page: 525-538
Author(s): Igor F. Tsigelny, Vladimir Kotlovyi, Linda Wasserman

Structural Aspects of Carbohydrates and the Relation with their Biological Properties

Journal: Current Medicinal Chemistry
Volume: 11 Issue: 1 Year: 2004 Page: 2565-2583
Author(s): Milos Hricovini

Progress Toward Understanding the Nature and Function of C-H...O Interactions

Journal: Current Organic Chemistry
Volume: 8 Issue: 1 Year: 2004 Page: 845-865
Author(s): Ronald K. Castellano

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