| Computer-aided nanotoxicology: assessing cytotoxicity of nanoparticles under diverse experimental conditions by using a novel QSTR-perturbation approach F Luan, VV Kleandrova, H González-Díaz, JM Ruso, A Melo, ... Nanoscale 6 (18), 10623-10630, 2014 | 162 | 2014 |
| Computational tool for risk assessment of nanomaterials: Novel QSTR-perturbation model for simultaneous prediction of ecotoxicity and cytotoxicity of uncoated and coated … A Speck-Planche, VV Kleandrova, F Luan, H Gonzalez-Diaz, JM Ruso, ... Environmental science & technology 48 (24), 14686-14694, 2014 | 157 | 2014 |
| Computational ecotoxicology: Simultaneous prediction of ecotoxic effects of nanoparticles under different experimental conditions VV Kleandrova, F Luan, H González-Díaz, JM Ruso, A Melo, ... Environment international 73, 288-294, 2014 | 134 | 2014 |
| Rational drug design for anti-cancer chemotherapy: Multi-target QSAR models for the in silico discovery of anti-colorectal cancer agents A Speck-Planche, VV Kleandrova, F Luan, M Cordeiro Bioorganic & Medicinal Chemistry 20 (15), 4848-4855, 2012 | 126 | 2012 |
| Probing the toxicity of nanoparticles: a unified in silico machine learning model based on perturbation theory R Concu, VV Kleandrova, A Speck-Planche, MNDS Cordeiro Nanotoxicology 11 (7), 891-906, 2017 | 104 | 2017 |
| Chemoinformatics in anti-cancer chemotherapy: Multi-target QSAR model for the in silico discovery of anti-breast cancer agents A Speck-Planche, VV Kleandrova, F Luan, M Cordeiro European Journal of Pharmaceutical Sciences 47 (1), 273-279, 2012 | 103 | 2012 |
| Enabling the discovery and virtual screening of potent and safe antimicrobial peptides. Simultaneous prediction of antibacterial activity and cytotoxicity VV Kleandrova, JM Ruso, A Speck-Planche, MN DS Cordeiro ACS Combinatorial Science 18 (8), 490-498, 2016 | 87 | 2016 |
| Multi-target drug discovery in anti-cancer therapy: Fragment-based approach toward the design of potent and versatile anti-prostate cancer agents A Speck-Planche, VV Kleandrova, F Luan, M Cordeiro Bioorganic & Medicinal Chemistry 19 (21), 6239-6244, 2011 | 87 | 2011 |
| Artificial Intelligence, Big data and Machine Learning Approaches in Precision Medicine & Drug Discovery A Nayarisseri, R Khandelwal, P Tanwar, M Madhavi, D Sharma, G Thakur, ... Current Drug targets 22 (6), 631-655, 2021 | 83 | 2021 |
| Predicting multiple ecotoxicological profiles in agrochemical fungicides: A multi-species chemoinformatic approach A Speck-Planche, VV Kleandrova, F Luan, M Cordeiro Ecotoxicology and Environmental Safety 80, 308-313, 2012 | 78 | 2012 |
| Current pharmaceutical design of antituberculosis drugs: future perspectives A Speck-Planche, M Tulius Scotti, V de Paulo-Emerenciano Current Pharmaceutical Design 16 (24), 2656-2665, 2010 | 71 | 2010 |
| Chemoinformatics in multi-target drug discovery for anti-cancer therapy: In silico design of potent and versatile anti-brain tumor agents A Speck-Planche, V V Kleandrova, F Luan, NDS Cordeiro Anti-Cancer Agents in Medicinal Chemistry 12 (6), 678-685, 2012 | 69 | 2012 |
| New insights toward the discovery of antibacterial agents: multi-tasking QSBER model for the simultaneous prediction of anti-tuberculosis activity and toxicological profiles of … A Speck-Planche, VV Kleandrova, M Cordeiro European Journal of Pharmaceutical Sciences 48 (4-5), 812–818, 2013 | 68 | 2013 |
| Speeding up early drug discovery in antiviral research: A fragment-based in silico approach for the design of virtual anti-hepatitis C leads A Speck-Planche, MN Dias Soeiro Cordeiro ACS Combinatorial Science 19 (8), 501-512, 2017 | 66 | 2017 |
| Fragment-based in silico modeling of multi-target inhibitors against breast cancer-related proteins A Speck-Planche, M Cordeiro Molecular Diversity 21 (3), 511-523, 2017 | 66 | 2017 |
| In Silico Discovery and Virtual Screening of Multi-Target Inhibitors for Proteins in Mycobacterium tuberculosis A Speck-Planche, V V Kleandrova, F Luan, NDS Cordeiro Combinatorial Chemistry & High Throughput Screening 15 (8), 666-673, 2012 | 66 | 2012 |
| Computational modeling in nanomedicine: prediction of multiple antibacterial profiles of nanoparticles using a quantitative structure-activity relationship perturbation model A Speck-Planche, VV Kleandrova, F Luan, MNDS Cordeiro Nanomedicine 10 (2), 193-204, 2015 | 64 | 2015 |
| Fragment-based approach for the in silico discovery of multi-target insecticides A Speck-Planche, VV Kleandrova, MT Scotti Chemometrics and Intelligent Laboratory Systems 111 (1), 39-45, 2012 | 63 | 2012 |
| Simultaneous virtual prediction of anti-Escherichia coli activities and ADMET profiles: A chemoinformatic complementary approach for high throughput screening A Speck-Planche, M Cordeiro ACS Combinatorial Science 16 (2), 78–84, 2014 | 61 | 2014 |
| Chemoinformatics for rational discovery of safe antibacterial drugs: simultaneous predictions of biological activity against streptococci and toxicological profiles in … A Speck-Planche, VV Kleandrova, M Cordeiro Bioorganic & Medicinal Chemistry 21 (10), 2727–2732, 2013 | 60 | 2013 |
Marcus Tullius ScottiDepartamento de Química在 ccae.ufpb.br 的电子邮件经过验证
