Rotondo R - Search Results

1

Bond-based 2D TOMOCOMD-CARDD approach for drug discovery: aiding decision-making in 'in silico' selection of new lead tyrosinase inhibitors.

Marrero-Ponce Y, Khan MT, Casañola-Martín GM, Ather A, Sultankhodzhaev MN, García-Domenech R, Torrens F, Rotondo R. Marrero-Ponce Y, et al. Among authors: rotondo r. J Comput Aided Mol Des. 2007 Apr;21(4):167-88. doi: 10.1007/s10822-006-9094-7. Epub 2007 Feb 28. J Comput Aided Mol Des. 2007. PMID: 17333484

2

TOMOCOMD-CARDD descriptors-based virtual screening of tyrosinase inhibitors: evaluation of different classification model combinations using bond-based linear indices.

Casañola-Martín GM, Marrero-Ponce Y, Khan MT, Ather A, Sultan S, Torrens F, Rotondo R. Casañola-Martín GM, et al. Among authors: rotondo r. Bioorg Med Chem. 2007 Feb 1;15(3):1483-503. doi: 10.1016/j.bmc.2006.10.067. Epub 2006 Nov 2. Bioorg Med Chem. 2007. PMID: 17110117

3

Bond-based global and local (bond, group and bond-type) quadratic indices and their applications to computer-aided molecular design. 1. QSPR studies of diverse sets of organic chemicals.

Marrero-Ponce Y, Torrens F, Alvarado YJ, Rotondo R. Marrero-Ponce Y, et al. Among authors: rotondo r. J Comput Aided Mol Des. 2006 Oct-Nov;20(10-11):685-701. doi: 10.1007/s10822-006-9089-4. Epub 2006 Nov 25. J Comput Aided Mol Des. 2006. PMID: 17186417

4

Prediction of tyrosinase inhibition activity using atom-based bilinear indices.

Marrero-Ponce Y, Khan MT, Casañola Martín GM, Ather A, Sultankhodzhaev MN, Torrens F, Rotondo R. Marrero-Ponce Y, et al. Among authors: rotondo r. ChemMedChem. 2007 Apr;2(4):449-78. doi: 10.1002/cmdc.200600186. ChemMedChem. 2007. PMID: 17366651

5

Predicting antitrichomonal activity: a computational screening using atom-based bilinear indices and experimental proofs.

Marrero-Ponce Y, Meneses-Marcel A, Castillo-Garit JA, Machado-Tugores Y, Escario JA, Barrio AG, Pereira DM, Nogal-Ruiz JJ, Arán VJ, Martínez-Fernández AR, Torrens F, Rotondo R, Ibarra-Velarde F, Alvarado YJ. Marrero-Ponce Y, et al. Among authors: rotondo r. Bioorg Med Chem. 2006 Oct 1;14(19):6502-24. doi: 10.1016/j.bmc.2006.06.016. Epub 2006 Jul 27. Bioorg Med Chem. 2006. PMID: 16875830

6

Dragon method for finding novel tyrosinase inhibitors: Biosilico identification and experimental in vitro assays.

Casañola-Martín GM, Marrero-Ponce Y, Khan MT, Ather A, Khan KM, Torrens F, Rotondo R. Casañola-Martín GM, et al. Among authors: rotondo r. Eur J Med Chem. 2007 Nov-Dec;42(11-12):1370-81. doi: 10.1016/j.ejmech.2007.01.026. Epub 2007 Feb 23. Eur J Med Chem. 2007. PMID: 17637486

7

A novel approach to predict aquatic toxicity from molecular structure.

Castillo-Garit JA, Marrero-Ponce Y, Escobar J, Torrens F, Rotondo R. Castillo-Garit JA, et al. Among authors: rotondo r. Chemosphere. 2008 Sep;73(3):415-27. doi: 10.1016/j.chemosphere.2008.05.024. Epub 2008 Jul 1. Chemosphere. 2008. PMID: 18597811

8

Atom-based stochastic and non-stochastic 3D-chiral bilinear indices and their applications to central chirality codification.

Castillo-Garit JA, Marrero-Ponce Y, Torrens F, Rotondo R. Castillo-Garit JA, et al. Among authors: rotondo r. J Mol Graph Model. 2007 Jul;26(1):32-47. doi: 10.1016/j.jmgm.2006.09.007. Epub 2006 Sep 26. J Mol Graph Model. 2007. PMID: 17110145

9

Resting-state electroencephalographic rhythms depend on sex in patients with dementia due to Parkinson's and Lewy Body diseases: An exploratory study.

Del Percio C, Lizio R, Lopez S, Noce G, Jakhar D, Carpi M, Bölükbaş B, Soricelli A, Salvatore M, Güntekin B, Yener G, Massa F, Arnaldi D, Famà F, Pardini M, Ferri R, Salerni M, Lanuzza B, Stocchi F, Vacca L, Coletti C, Marizzoni M, Taylor JP, Hanoğlu L, Helvacı Yılmaz N, Kıyı İ, Özbek-İşbitiren Y, Frisoni GB, Cuoco S, Barone P, D'Anselmo A, Bonanni L, Biundo R, D'Antonio F, Bruno G, Giubilei F, De Pandis F, Rotondo R, Antonini A, Babiloni C. Del Percio C, et al. Among authors: rotondo r. Neurobiol Dis. 2025 Jan 22;206:106807. doi: 10.1016/j.nbd.2025.106807. Online ahead of print. Neurobiol Dis. 2025. PMID: 39855475 Free article.

10

Role of Protein Tyrosine Phosphatases in Inflammatory Bowel Disease, Celiac Disease and Diabetes: Focus on the Intestinal Mucosa.

Bellomo C, Furone F, Rotondo R, Ciscognetti I, Carpinelli M, Nicoletti M, D'Aniello G, Sepe L, Barone MV, Nanayakkara M. Bellomo C, et al. Among authors: rotondo r. Cells. 2024 Nov 29;13(23):1981. doi: 10.3390/cells13231981. Cells. 2024. PMID: 39682729 Free PMC article. Review.

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