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Understanding the Bond Formation in Hetero-Diels-Alder Reactions. An ELF Analysis of the Reaction of Nitroethylene with Dimethylvinylamine

Journal: Current Organic Chemistry
Volume: 16 Issue: 1 Year: 2012 Page: 2343-2351
Author(s): Luis R. Domingo, Patricia Perez, M. Jose Aurell, Jose A. Saez

Polar Diels-Alder Reactions Developed in a Protic Ionic Liquid: 3-Nitroindole as Dienophile. Theoretical Studies Using DFT Methods

Journal: Letters in Organic Chemistry
Volume: 9 Issue: 1 Year: 2012 Page: 691-695
Author(s): Claudia D. D. Rosa, Carla M. Ormachea, Ana S. Sonzogni, Maria N. Kneeteman, Luis R. Domingo, Pedro M. E. Mancini

15-Deoxy-Δ 12,14-Prostaglandin J2 Exerts Pro- and Anti-Inflammatory Effects in Mesangial Cells in a Concentration-Dependent Manner

Journal: Inflammation & Allergy - Drug Targets (Discontinued)
Volume: 11 Issue: 1 Year: 2012 Page: 58-65
Author(s): Alma E. Martinez, Francisco J. Sanchez-Gomez, Beatriz Diez-Dacal, Clara L. Oeste, Dolores Perez-Sala

An In Silico Stereo-electronic Comparison of Conventional Pyridinium Oximes and K-oximes for Organophosphate (OP) Poisoning

Journal: Medicinal Chemistry
Volume: 8 Issue: 2 Year: 2012 Page: 230-245
Author(s): Apurba K. Bhattacharjee, Kamil Kuca, Kamil Musilek, Richard K. Gordon

Relationship Between Phenol-Induced Cytotoxicity and Experimental Inhibition Rate Constant or a Theoretical Parameter

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 12 Issue: 6 Year: 2012 Page: 477-490
Author(s): S. Fujisawa,Y. Kadoma

Tuning the Electronic Properties by Width and Length Modifications of Narrow- Diameter Carbon Nanotubes for Nanomedicine

Journal: Current Medicinal Chemistry
Volume: 19 Issue: 30 Year: 2012 Page: 5219-5225
Author(s): A. Poater,A.G. Saliner,L. Cavallo,M. Poch,M. Sola,A.P. Worth

Regio- and Stereoselectivity of the 1,3-Dipolar Cycloaddition of Pyridinium-3-olates and Pyrazinium-3-olates with Methyl Methacrylate: A Density Functional Theory Exploration

Journal: Current Organic Chemistry
Volume: 16 Issue: 14 Year: 2012 Page: 1711-1722
Author(s): Lydia Rhyman,Hassan H. Abdallah,Sabina Jhaumeer-Laulloo,Luis R. Domingo,John A. Joule,Ponnadurai Ramasami

Pharmacokinetic and Pharmacogenetic Analysis of Oral Busulfan in Stem Cell Transplantation: Prediction of Poor Drug Metabolism to Prevent Drug Toxicity

Journal: Current Drug Safety
Volume: 7 Issue: 3 Year: 2012 Page: 211-217
Author(s): Norberto Krivoy,Tsila Zuckerman,Hela Elkin,Lia Froymovich,Jacob M. Rowe,Edna Efrati

In Silico Quantitative Structure Toxicity Relationship of Chemical Compounds: Some Case Studies

Journal: Current Drug Safety
Volume: 7 Issue: 4 Year: 2012 Page: 289-297
Author(s): Omar Deeb,Mohammad Goodarzi

The Efficacy of Conceptual DFT Descriptors and Docking Scores on the QSAR Models of HIV Protease Inhibitors

Journal: Medicinal Chemistry
Volume: 8 Issue: 5 Year: 2012 Page: 811-825
Author(s): Hemant Kumar Srivastava,Chinmayee Choudhury,G. Narahari Sastry

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