Contreras R - Search Results

1

Nucleophilicity index from perturbed electrostatic potentials.

Cedillo A, Contreras R, Galván M, Aizman A, Andrés J, Safont VS. Cedillo A, et al. Among authors: contreras r. J Phys Chem A. 2007 Mar 29;111(12):2442-7. doi: 10.1021/jp068459o. Epub 2007 Mar 8. J Phys Chem A. 2007. PMID: 17388330

2

On the principle of spin potential equalization.

Guerra D, Contreras R, Cedillo A, Aizman A, Fuentealba P. Guerra D, et al. Among authors: contreras r. J Phys Chem A. 2009 Feb 19;113(7):1390-6. doi: 10.1021/jp8066348. J Phys Chem A. 2009. PMID: 19149464

3

Exploring two-state reactivity pathways in the cycloaddition reactions of triplet methylene.

Pérez P, Andrés J, Safont VS, Contreras R, Tapia O. Pérez P, et al. Among authors: contreras r. J Phys Chem A. 2005 May 12;109(18):4178-84. doi: 10.1021/jp044701k. J Phys Chem A. 2005. PMID: 16833743

4

Lewis molecular acidity of ionic liquids from empirical energy-density models.

Contreras R, Aizman A, Tapia RA, Cerda-Monje A. Contreras R, et al. J Phys Chem B. 2013 Feb 14;117(6):1911-20. doi: 10.1021/jp3114946. Epub 2013 Jan 30. J Phys Chem B. 2013. PMID: 23323706

5

Solvent effects in ionic liquids: empirical linear energy-density relationships.

Cerda-Monje A, Aizman A, Tapia RA, Chiappe C, Contreras R. Cerda-Monje A, et al. Among authors: contreras r. Phys Chem Chem Phys. 2012 Jul 28;14(28):10041-9. doi: 10.1039/c2cp40619e. Epub 2012 Jun 19. Phys Chem Chem Phys. 2012. PMID: 22711339

6

Bond Fukui functions as descriptor of the electron density reorganization in π conjugated systems.

Gonzalez-Suarez M, Aizman A, Soto-Delgado J, Contreras R. Gonzalez-Suarez M, et al. Among authors: contreras r. J Org Chem. 2012 Jan 6;77(1):90-5. doi: 10.1021/jo201465g. Epub 2011 Dec 6. J Org Chem. 2012. PMID: 22126265

7

Comparison between experimental and theoretical scales of electrophilicity in benzhydryl cations.

Pérez P, Toro-Labbé A, Aizman A, Contreras R. Pérez P, et al. Among authors: contreras r. J Org Chem. 2002 Jul 12;67(14):4747-52. doi: 10.1021/jo020255q. J Org Chem. 2002. PMID: 12098284

8

On the catalytic effect of water in the intramolecular Diels–Alder reaction of quinone systems: a theoretical study.

Soto-Delgado J, Aizman A, Contreras R, Domingo LR. Soto-Delgado J, et al. Among authors: contreras r. Molecules. 2012 Nov 20;17(11):13687-703. doi: 10.3390/molecules171113687. Molecules. 2012. PMID: 23169266 Free PMC article.

9

Definition of a nucleophilicity scale.

Jaramillo P, Pérez P, Contreras R, Tiznado W, Fuentealba P. Jaramillo P, et al. Among authors: contreras r. J Phys Chem A. 2006 Jul 6;110(26):8181-7. doi: 10.1021/jp057351q. J Phys Chem A. 2006. PMID: 16805506

10

Theoretical study on CDK2 inhibitors using a global softness obtained from the density of states.

Alzate-Morales JH, Tiznado W, Santos JC, Cárdenas C, Contreras R. Alzate-Morales JH, et al. Among authors: contreras r. J Phys Chem B. 2007 Mar 29;111(12):3293-7. doi: 10.1021/jp064549h. Epub 2007 Mar 3. J Phys Chem B. 2007. PMID: 17388447

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

754 results

Search Page

Filters