Detalles de la búsqueda
1.
Prediction of multi-target networks of neuroprotective compounds with entropy indices and synthesis, assay, and theoretical study of new asymmetric 1,2-rasagiline carbamates.
Int J Mol Sci
; 15(9): 17035-64, 2014 Sep 24.
Artículo
en Inglés
| MEDLINE | ID: mdl-25255029
2.
ANN multiplexing model of drugs effect on macrophages; theoretical and flow cytometry study on the cytotoxicity of the anti-microbial drug G1 in spleen.
Bioorg Med Chem
; 20(20): 6181-94, 2012 Oct 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-22981917
3.
Trypano-PPI: a web server for prediction of unique targets in trypanosome proteome by using electrostatic parameters of protein-protein interactions.
J Proteome Res
; 9(2): 1182-90, 2010 Feb 05.
Artículo
en Inglés
| MEDLINE | ID: mdl-19947655
4.
Unified QSAR & network-based computational chemistry approach to antimicrobials. II. Multiple distance and triadic census analysis of antiparasitic drugs complex networks.
J Comput Chem
; 31(1): 164-73, 2010 Jan 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-19421992
5.
Multi-target spectral moment QSAR versus ANN for antiparasitic drugs against different parasite species.
Bioorg Med Chem
; 18(6): 2225-2231, 2010 Mar 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-20185316
6.
QSAR for RNases and theoretic-experimental study of molecular diversity on peptide mass fingerprints of a new Leishmania infantum protein.
Mol Divers
; 14(2): 349-69, 2010 May.
Artículo
en Inglés
| MEDLINE | ID: mdl-19578942
7.
Complex network spectral moments for ATCUN motif DNA cleavage: first predictive study on proteins of human pathogen parasites.
J Proteome Res
; 8(11): 5219-28, 2009 Nov.
Artículo
en Inglés
| MEDLINE | ID: mdl-19817378
8.
Unified QSAR approach to antimicrobials. 4. Multi-target QSAR modeling and comparative multi-distance study of the giant components of antiviral drug-drug complex networks.
Bioorg Med Chem
; 17(2): 569-75, 2009 Jan 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-19112024
9.
Study of peptide fingerprints of parasite proteins and drug-DNA interactions with Markov-Mean-Energy invariants of biopolymer molecular-dynamic lattice networks.
Polymer (Guildf)
; 50(15): 3857-3870, 2009 Jul 17.
Artículo
en Inglés
| MEDLINE | ID: mdl-32287404
10.
Unified QSAR and network-based computational chemistry approach to antimicrobials, part 1: multispecies activity models for antifungals.
J Comput Chem
; 29(4): 656-67, 2008 Mar.
Artículo
en Inglés
| MEDLINE | ID: mdl-17999385
11.
Unified QSAR approach to antimicrobials. Part 3: first multi-tasking QSAR model for input-coded prediction, structural back-projection, and complex networks clustering of antiprotozoal compounds.
Bioorg Med Chem
; 16(11): 5871-80, 2008 Jun 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-18485714
12.
Review of Theoretical Models to Study Natural Products with Antiprotozoal Activity.
Curr Drug Targets
; 18(5): 605-616, 2017.
Artículo
en Inglés
| MEDLINE | ID: mdl-28017125
13.
Review of Theoretical Prediction Models for Organic Extract Metabolites, Effect of Drying Temperature on Smooth Muscle Relaxing Activity Induced by Organic Extracts Specially Cecropia Obtusifolia Portal and Web Server Predictors of Drug-Protein Interaction.
Mini Rev Med Chem
; 2015 Feb 19.
Artículo
en Inglés
| MEDLINE | ID: mdl-25694070
14.
Galvez-Markov network transferability indices: review of classic theory and new model for perturbations in metabolic reactions.
Curr Drug Metab
; 15(5): 557-64, 2014.
Artículo
en Inglés
| MEDLINE | ID: mdl-24909421
15.
Model for high-throughput screening of drug immunotoxicity--study of the anti-microbial G1 over peritoneal macrophages using flow cytometry.
Eur J Med Chem
; 72: 206-20, 2014 Jan 24.
Artículo
en Inglés
| MEDLINE | ID: mdl-24445280
16.
Entropy model for multiplex drug-target interaction endpoints of drug immunotoxicity.
Curr Top Med Chem
; 13(14): 1636-49, 2013.
Artículo
en Inglés
| MEDLINE | ID: mdl-23889053
17.
From QSAR models of drugs to complex networks: state-of-art review and introduction of new Markov-spectral moments indices.
Curr Top Med Chem
; 12(8): 927-60, 2012.
Artículo
en Inglés
| MEDLINE | ID: mdl-22352918
18.
MISS-Prot: web server for self/non-self discrimination of protein residue networks in parasites; theory and experiments in Fasciola peptides and Anisakis allergens.
Mol Biosyst
; 7(6): 1938-55, 2011 Jun.
Artículo
en Inglés
| MEDLINE | ID: mdl-21468430
19.
Multi-target spectral moments for QSAR and Complex Networks study of antibacterial drugs.
Eur J Med Chem
; 44(11): 4516-21, 2009 Nov.
Artículo
en Inglés
| MEDLINE | ID: mdl-19631422
20.
Multi-target spectral moment: QSAR for antifungal drugs vs. different fungi species.
Eur J Med Chem
; 44(10): 4051-6, 2009 Oct.
Artículo
en Inglés
| MEDLINE | ID: mdl-19467743