| Application of computer-aided drug repurposing in the search of new cruzipain inhibitors: discovery of amiodarone and bromocriptine inhibitory effects CL Bellera, DE Balcazar, L Alberca, CA Labriola, A Talevi, C Carrillo Journal of chemical information and modeling 53 (9), 2402-2408, 2013 | 56 | 2013 |
| Discovery of novel polyamine analogs with anti-protozoal activity by computer guided drug repositioning LN Alberca, ML Sbaraglini, D Balcazar, L Fraccaroli, C Carrillo, ... Journal of computer-aided molecular design 30, 305-321, 2016 | 52 | 2016 |
| Strengths and weaknesses of docking simulations in the SARS-CoV-2 era: the main protease (Mpro) case study MA Llanos, ME Gantner, S Rodriguez, LN Alberca, CL Bellera, A Talevi, ... Journal of Chemical Information and Modeling 61 (8), 3758-3770, 2021 | 46 | 2021 |
| In silico Guided Drug Repurposing: Discovery of New Competitive and Non-competitive Inhibitors of Falcipain-2 LN Alberca, SR Chuguransky, CL Álvarez, A Talevi, E Salas-Sarduy Frontiers in chemistry 7, 534, 2019 | 28 | 2019 |
| Identification of Levothyroxine Antichagasic Activity through Computer‐Aided Drug Repurposing CL Bellera, DE Balcazar, L Alberca, CA Labriola, A Talevi, C Carrillo The Scientific World Journal 2014 (1), 279618, 2014 | 28 | 2014 |
| Cascade ligand-and structure-based virtual screening to identify new trypanocidal compounds inhibiting putrescine uptake LN Alberca, ML Sbaraglini, JF Morales, R Dietrich, MD Ruiz, ... Frontiers in Cellular and Infection Microbiology 8, 173, 2018 | 23 | 2018 |
| In silico drug repositioning for Chagas disease CL Bellera, LN Alberca, ML Sbaraglini, A Talevi Current Medicinal Chemistry 27 (5), 662-675, 2020 | 21 | 2020 |
| Application of target repositioning and in silico screening to exploit fatty acid binding proteins (FABPs) from Echinococcus multilocularis as possible drug targets JA Bélgamo, LN Alberca, JL Pórfido, FNC Romero, S Rodriguez, A Talevi, ... Journal of Computer-Aided Molecular Design 34, 1275-1288, 2020 | 20 | 2020 |
| Identification of cisapride as new inhibitor of putrescine uptake in Trypanosoma cruzi by combined ligand-and structure-based virtual screening RC Dietrich, LN Alberca, MD Ruiz, PH Palestro, C Carrillo, A Talevi, ... European Journal of Medicinal Chemistry 149, 22-29, 2018 | 15 | 2018 |
| iRaPCA and SOMoC: Development and validation of web applications for new approaches for the clustering of small molecules DN Prada Gori, MA Llanos, CL Bellera, A Talevi, LN Alberca Journal of Chemical Information and Modeling 62 (12), 2987-2998, 2022 | 12 | 2022 |
| LIDeB tools: A Latin American resource of freely available, open-source cheminformatics apps DNP Gori, LN Alberca, S Rodriguez, JI Alice, MA Llanos, CL Bellera, ... Artificial Intelligence in the Life Sciences 2, 100049, 2022 | 11 | 2022 |
| In silico modeling of FDA-approved drugs for discovery of therapies against neglected diseases: a drug repurposing approach CL Belllera, ML Sbaraglini, LN Alberca, JI Alice, A Talevi In silico drug design, 625-648, 2019 | 8 | 2019 |
| Prokaryotic membrane coat - like proteins: An update L Ferrelli, M Pidre, R García-Domínguez, L Alberca, M Del Saz-Navarro, ... Journal of Structural Biology 215 (3), 107987, 2023 | 6 | 2023 |
| The efficiency of multi-target drugs: a network approach LN Alberca, A Talevi Approaching Complex Diseases: Network-Based Pharmacology and Systems …, 2020 | 5 | 2020 |
| A combined ligand and target-based virtual screening strategy to repurpose drugs as putrescine uptake inhibitors with trypanocidal activity MA Llanos, LN Alberca, MD Ruiz, ML Sbaraglini, C Miranda, ... Journal of Computer-Aided Molecular Design 37 (2), 75-90, 2023 | 4 | 2023 |
| Tetracycline derivatives inhibit plasmodial cysteine protease falcipain-2 through binding to a distal allosteric site JE Hernandez Gonzalez, LN Alberca, Y Masforrol Gonzalez, ... Journal of Chemical Information and Modeling 62 (1), 159-175, 2021 | 4 | 2021 |
| Positive predictive value surfaces as a complementary tool to assess the performance of virtual screening methods JF Morales, S Chuguransky, LN Alberca, JI Alice, S Goicoechea, ME Ruiz, ... Mini Reviews in Medicinal Chemistry 20 (14), 1447-1460, 2020 | 4 | 2020 |
| Drug repurposing screening validated by experimental assays identifies two clinical drugs targeting SARS-CoV-2 main protease DN Prada Gori, S Ruatta, M Fló, LN Alberca, CL Bellera, S Park, J Heo, ... Frontiers in Drug Discovery 2, 1082065, 2023 | 3 | 2023 |
| Homology Modeling and Molecular Dynamics Simulations of Trypanosoma cruzi Phosphodiesterase b1 MA Llanos, LN Alberca, SCV Larrea, AC Schoijet, GD Alonso, CL Bellera, ... Chemistry & Biodiversity 19 (1), e202100712, 2022 | 3 | 2022 |
| Machine learning search of novel selective NaV1. 2 and NaV1. 6 inhibitors as potential treatment against dravet syndrome M Fallico, LN Alberca, DNP Gori, L Gavernet, A Talevi Latin American Workshop on Computational Neuroscience, 101-118, 2021 | 3 | 2021 |
Alan TaleviProfesor de la Facultad de Ciencias Exactas - Universidad Nacional de La Plata在 biol.unlp.edu.ar 的电子邮件经过验证
