| Potential Antileukemia Effect and Structural Analyses of SRPK Inhibition by N-(2-(Piperidin-1-yl)-5-(Trifluoromethyl)Phenyl)Isonicotinamide (SRPIN340) RP Siqueira, ÉAA Barbosa, MD Polêto, GL Righetto, TV Seraphim, ... PloS one 10 (8), e0134882, 2015 | 81 | 2015 |
| Influence of Na+ and Mg2+ ions on RNA structures studied with molecular dynamics simulations NM Fischer, MD Polêto, J Steuer, D van der Spoel Nucleic acids research 46 (10), 4872-4882, 2018 | 66 | 2018 |
| Aromatic rings commonly used in medicinal chemistry: force fields comparison and interactions with water toward the design of new chemical entities MD Polêto, VH Rusu, BI Grisci, M Dorn, RD Lins, H Verli Frontiers in pharmacology 9, 395, 2018 | 56 | 2018 |
| Making it rain: cloud-based molecular simulations for everyone PR Arantes, MD Polêto, C Pedebos, R Ligabue-Braun Journal of Chemical Information and Modeling 61 (10), 4852-4856, 2021 | 50 | 2021 |
| Discovery of novel West Nile Virus protease inhibitor based on isobenzonafuranone and triazolic derivatives of eugenol and indan-1, 3-dione scaffolds AS de Oliveira, PAR Gazolla, AFCS Oliveira, WL Pereira, LC de S. Viol, ... PLoS One 14 (9), e0223017, 2019 | 16 | 2019 |
| [28] Hexaphyrin derivatives for anion recognition in organic and aqueous media F Figueira, ASF Farinha, PV Muteto, MD Polêto, H Verli, MTSR Gomes, ... Chemical communications 52 (10), 2181-2184, 2016 | 15 | 2016 |
| Integration of experimental data and use of automated fitting methods in developing protein force fields MD Polêto, JA Lemkul Communications chemistry 5 (1), 38, 2022 | 14 | 2022 |
| An unusual intramolecular halogen bond guides conformational selection R Tesch, C Becker, MP Müller, ME Beck, L Quambusch, M Getlik, ... Angewandte Chemie International Edition 57 (31), 9970-9975, 2018 | 13 | 2018 |
| Homology modeling and molecular dynamics provide structural insights into tospovirus nucleoprotein RN Lima, M Faheem, JARG Barbosa, MD Polêto, H Verli, FL Melo, ... BMC bioinformatics 17, 11-17, 2016 | 13 | 2016 |
| Role of structural ions on the dynamics of the pseudomonas fluorescens 07a metalloprotease MD Polêto, MP Alves, R Ligabue-Braun, MR Eller, AF De Carvalho Food Chemistry, 2019 | 11 | 2019 |
| Casein-derived peptides with antihypertensive potential: Production, identification and assessment of complex formation with angiotensin I-converting enzyme (ACE) through … TV De Oliveira, MD Polêto, MR De Oliveira, TJ Silva, E Barros, ... Food biophysics 15, 162-172, 2020 | 10 | 2020 |
| Evaluation of a synthetic peptide from the Taenia saginata 18 kDa surface/secreted oncospheral adhesion protein for serological diagnosis of bovine cysticercosis RPM Guimarães-Peixoto, PSA Pinto, MR Santos, MD Polêto, LF Silva, ... Acta Tropica 164, 463-468, 2016 | 10 | 2016 |
| A porcine circovirus-2 mutant isolated in Brazil contains low-frequency substitutions in regions of immunoprotective epitopes in the capsid protein RL Salgado, PMP Vidigal, NF Gonzaga, LFL de Souza, MD Polêto, ... Archives of virology 160, 2741-2748, 2015 | 10 | 2015 |
| TUPÃ: Electric field analyses for molecular simulations MD Polêto, JA Lemkul Journal of computational chemistry 43 (16), 1113-1119, 2022 | 9 | 2022 |
| Development of GROMOS-compatible parameter set for simulations of chalcones and flavonoids PR Arantes, MD Polêto, EBO John, C Pedebos, BI Grisci, M Dorn, ... The Journal of Physical Chemistry B 123 (5), 994-1008, 2019 | 9 | 2019 |
| Impacts of Ca2+ cation and temperature on bovine α-lactalbumin secondary structures and foamability–Insights from computational molecular dynamics TV De Oliveira, MD Polêto, SV Barbosa, JS dos Reis Coimbra, ... Food Chemistry 367, 130733, 2022 | 8 | 2022 |
| ENTPDases from pathogenic trypanosomatids and purinergic signaling: shedding light towards biotechnological applications W da Silva, N da Rocha Torres, J de Melo Agripino, VHF da Silva, ... Current Topics in Medicinal Chemistry 21 (3), 213-226, 2021 | 8 | 2021 |
| Structural and molecular bases of angiotensin-converting enzyme inhibition by bovine casein-derived peptides: an in silico molecular dynamics approach TV De Oliveira, AP Guimarães, GC Bressan, ER Maia, JSR Coimbra, ... Journal of Biomolecular Structure and Dynamics 39 (4), 1386-1403, 2021 | 7 | 2021 |
| ESI‐MS/MS of expanded porphyrins: a look into their structure and aromaticity CIV Ramos, F Figueira, MD Polêto, FML Amado, H Verli, JPC Tomé, ... Journal of Mass Spectrometry 51 (5), 342-349, 2016 | 7 | 2016 |
| The lazy life of lipid-linked oligosaccharides in all life domains PR Arantes, C Pedebos, MD Polêto, L Pol-Fachin, H Verli Journal of chemical information and modeling 60 (2), 631-643, 2019 | 6 | 2019 |
Hugo VerliProfessor de Bioinformática, Centro de Biotecnologia, Universidade Federal do Rio Grande do Sulcbiot.ufrgs.br üzerinde doğrulanmış e-posta adresine sahip
