81
TITLE: Probing the efficiency of platinum nanotubes for the H-2 production by water gas shift reaction: A DFT study  Full Text
AUTHORS: Fajín, JLC ; D.S. Cordeiro, MN ;
PUBLISHED: 2020, SOURCE: APPLIED CATALYSIS B-ENVIRONMENTAL, VOLUME: 263
INDEXED IN: Scopus WOS CrossRef: 19
IN MY: ORCID
82
TITLE: PTML Multi-Label Algorithms: Models, Software, and Applications
AUTHORS: Ortega Tenezaca, B; Quevedo Tumailli, V; Bediaga, H; Collados, J; Arrasate, S; Madariaga, G; Munteanu, CR; Cordeiro, MNDS ; Gonzalez Diaz, H;
PUBLISHED: 2020, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 20, ISSUE: 25
INDEXED IN: Scopus WOS CrossRef: 8
IN MY: ORCID
85
TITLE: Theoretical insights on helix repacking as the origin of P-glycoprotein promiscuity  Full Text
AUTHORS: Bonito, CA; Ferreira, RJ; Ferreira, MJU; Gillet, JP; Cordeiro, MNDS ; dos Santos, DJVA;
PUBLISHED: 2020, SOURCE: SCIENTIFIC REPORTS, VOLUME: 10, ISSUE: 1
INDEXED IN: Scopus WOS CrossRef: 15
IN MY: ORCID
86
TITLE: Understanding the Binding Specificity of G-Protein Coupled Receptors toward G-Proteins and Arrestins: Application to the Dopamine Receptor Family  Full Text
AUTHORS: Preto, AJ; Barreto, CAV; Baptista, SJ; de Almeida, JG; Lemos, A; Melo, A ; Cordeiro, MNDS ; Kurkcuoglu, Z; Melo, R; Moreira, IS;
PUBLISHED: 2020, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 60, ISSUE: 8
INDEXED IN: Scopus WOS CrossRef: 7
IN MY: ORCID
87
TITLE: Advanced chemometric modeling approaches for the design of multitarget drugs against neurodegenerative diseases
AUTHORS: Halder, AK ; Moura, AS ; Cordeiro, MNDS ;
PUBLISHED: 2019, SOURCE: Methods in Pharmacology and Toxicology
INDEXED IN: Scopus CrossRef: 3
IN MY: ORCID
88
TITLE: Alignment-Free Method to Predict Enzyme Classes and Subclasses  Full Text
AUTHORS: Riccardo Concu ; Natalia N D S Cordeiro ;
PUBLISHED: 2019, SOURCE: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, VOLUME: 20, ISSUE: 21
INDEXED IN: Scopus WOS CrossRef: 18
IN MY: ORCID
89
TITLE: CompScore: Boosting Structure-Based Virtual Screening Performance by Incorporating Docking Scoring Function Components into Consensus Scoring  Full Text
AUTHORS: Yunierkis Perez Castillo; Stellamaris Sotomayor Burneo; Karina Jimenes Vargas; Mario Gonzalez Rodriguez; Maykel Cruz Monteagudo; Vinicio Armijos Jaramillo; Natalia N D S Cordeiro ; Fernanda Borges ; Aminael Sanchez Rodriguez; Eduardo Tejera;
PUBLISHED: 2019, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 59, ISSUE: 9
INDEXED IN: Scopus WOS
IN MY: ORCID
90
TITLE: CompScore: boosting structure-based virtual screening performance by incorporating docking scoring functions components into consensus scoring
AUTHORS: Yunierkis Perez-Castillo; Stellamaris Sotomayor-Burneo; Karina Jimenes-Vargas; Mario Gonzalez-Rodriguez; Maykel Cruz-Monteagudo; Vinicio Armijos-Jaramillo; Natália N D S Cordeiro ; Fernanda Borges ; Aminael Sánchez-Rodríguez; Eduardo Tejera;
PUBLISHED: 2019
INDEXED IN: CrossRef: 1
IN MY: ORCID
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