Quimat - Cheminformatics and Materials (Quimat)
AuthID: I-000-BCW
Publications Actions
Publications at Authenticus Institutional Profile
An Authenticus institution (group) is an organization which consists of a set of researchers (institutional/group team). The set of researchers depends on the organizational structure of the institution per year and can be set at the institution profile, under ‘Researchers’ interface. Based on the institutional team we produce listings of publications, statistics and institutional reports.
Publications displayed at an Authenticus institutional profile depend on two parameters:
- Researchers team associated with the institution per year.
- Publications source type.
We define 3 types of publication sources:
- Validated by team members - includes all publications validated by team members. Requires the definition of the institutional team.
- All published by team members - includes all publications validated by the institution team members plus all not-validated (only identified) publications. Requires the definition of the institutional team.
- Affiliation Based - includes publications that have the institution/group in the publication affiliation. Does not require institutional team, but at the same time does not guarantee that all publications will be listed.
External
Internal
No data about last update.
Rules:
This actions updates publications citations of every team member.
Only validated by team members publications are included.
Only the current year team is included in this action.>
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a month!
Only validated by team members publications are included.
Only the current year team is included in this action.>
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a month!
No data about last update.
Rules:
This actions updates all pre print publications of the group/institution.
Only validated by current year team members publications are included.
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a day!
Only validated by current year team members publications are included.
The action is executed in the background, thus the results are NOT immediate.
This actions can be executed only once a day!
Publications Count: 654
15 Team MembersFilters -> Year: 2026
321
TITLE: Ligand-and structure-based drug design of non-steroidal aromatase inhibitors (NSAIs) in breast cancer
AUTHORS: Jha, T; Adhikari, N; Halder, AK ; Saha, A;
PUBLISHED: 2015, SOURCE: Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment, PAGES: 400-470
AUTHORS: Jha, T; Adhikari, N; Halder, AK ; Saha, A;
PUBLISHED: 2015, SOURCE: Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment, PAGES: 400-470
322
TITLE: Mechanistic Study of Carbon Monoxide Methanation over Pure and Rhodium- or Ruthenium-Doped Nickel Catalysts
AUTHORS: Jose L C Fajin ; Jose R B Gomes; Natalia N D S Cordeiro ;
PUBLISHED: 2015, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 119, ISSUE: 29, PAGES: 16537-16551
AUTHORS: Jose L C Fajin ; Jose R B Gomes; Natalia N D S Cordeiro ;
PUBLISHED: 2015, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 119, ISSUE: 29, PAGES: 16537-16551
323
TITLE: Mitoprotective activity of oxidized carbon nanotubes against mitochondrial swelling induced in multiple experimental conditions and predictions with new expected-value perturbation theory
AUTHORS: González Durruthy, M ; Monserrat, JM; Alberici, LC; Naal, Z; Curti, C; González Díaz, H;
PUBLISHED: 2015, SOURCE: RSC Advances, VOLUME: 5, ISSUE: 125, PAGES: 103229-103245
AUTHORS: González Durruthy, M ; Monserrat, JM; Alberici, LC; Naal, Z; Curti, C; González Díaz, H;
PUBLISHED: 2015, SOURCE: RSC Advances, VOLUME: 5, ISSUE: 125, PAGES: 103229-103245
324
TITLE: Molecular Dynamics Simulations of Poly(ethylene oxide) Grafted onto Silica Immersed in Melt of Homopolymers Full Text
AUTHORS: Zuzana Benkova; Natalia N D S Cordeiro ;
PUBLISHED: 2015, SOURCE: LANGMUIR, VOLUME: 31, ISSUE: 37, PAGES: 10254-10264
AUTHORS: Zuzana Benkova; Natalia N D S Cordeiro ;
PUBLISHED: 2015, SOURCE: LANGMUIR, VOLUME: 31, ISSUE: 37, PAGES: 10254-10264
325
TITLE: Molecular Dynamics Study of the Gold/Ionic Liquids Interface
AUTHORS: Elisabete S C Ferreira ; Carlos M Pereira ; Natalia N D S Cordeiro ; Daniel J V A dos Santos ;
PUBLISHED: 2015, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 119, ISSUE: 30, PAGES: 9883-9892
AUTHORS: Elisabete S C Ferreira ; Carlos M Pereira ; Natalia N D S Cordeiro ; Daniel J V A dos Santos ;
PUBLISHED: 2015, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 119, ISSUE: 30, PAGES: 9883-9892
326
TITLE: Molecularly Imprinted Sol-Gel Materials for Medical Applications
AUTHORS: Riccardo Concu ; Mariana Ornelas; Manuel Azenha ;
PUBLISHED: 2015, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 3, PAGES: 199-222
AUTHORS: Riccardo Concu ; Mariana Ornelas; Manuel Azenha ;
PUBLISHED: 2015, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 3, PAGES: 199-222
327
TITLE: Multi-Target Drug Discovery in Medicinal Chemistry: Current Status and Future Perspectives
AUTHORS: Alejandro Speck Planche; Natalia N D S Cordeiro ;
PUBLISHED: 2015, SOURCE: MINI-REVIEWS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 8, PAGES: 606-607
AUTHORS: Alejandro Speck Planche; Natalia N D S Cordeiro ;
PUBLISHED: 2015, SOURCE: MINI-REVIEWS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 8, PAGES: 606-607
INDEXED IN: 
Scopus 
WOS
Scopus WOS328
TITLE: Multi-Target QSAR Approaches for Modeling Protein Inhibitors. Simultaneous Prediction of Activities Against Biomacromolecules Present in Gram-Negative Bacteria
AUTHORS: Alejandro Speck-Planche; M.N.D.S Cordeiro ;
PUBLISHED: 2015, SOURCE: Current Topics in Medicinal Chemistry, VOLUME: 15, ISSUE: 18, PAGES: 1801-1813
AUTHORS: Alejandro Speck-Planche; M.N.D.S Cordeiro ;
PUBLISHED: 2015, SOURCE: Current Topics in Medicinal Chemistry, VOLUME: 15, ISSUE: 18, PAGES: 1801-1813
329
TITLE: Multi-Target QSAR Approaches for Modeling Protein Inhibitors. Simultaneous Prediction of Activities Against Biomacromolecules Present in Gram-Negative Bacteria
AUTHORS: Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2015, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 18, PAGES: 1801-1813
AUTHORS: Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2015, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 18, PAGES: 1801-1813
INDEXED IN: Scopus WOS
Scopus WOS330
TITLE: Multitasking models for quantitative structure-biological effect relationships: current status and future perspectives to speed up drug discovery
AUTHORS: Alejandro Speck Planche; Maria Natalia D S Dias Soeiro Cordeiro ;
PUBLISHED: 2015, SOURCE: EXPERT OPINION ON DRUG DISCOVERY, VOLUME: 10, ISSUE: 3, PAGES: 245-256
AUTHORS: Alejandro Speck Planche; Maria Natalia D S Dias Soeiro Cordeiro ;
PUBLISHED: 2015, SOURCE: EXPERT OPINION ON DRUG DISCOVERY, VOLUME: 10, ISSUE: 3, PAGES: 245-256
331
TITLE: NCI analysis of the interaction cation⋯π in complexes with molecular bowls derived from fullerene Full Text
AUTHORS: Iván González-Veloso ; Jorge A Carrazana-García; Daniela Josa; Jesús Rodríguez-Otero; Enrique M Cabaleiro-Lago;
PUBLISHED: 2015, SOURCE: Computational and Theoretical Chemistry, VOLUME: 1053, PAGES: 123-129
AUTHORS: Iván González-Veloso ; Jorge A Carrazana-García; Daniela Josa; Jesús Rodríguez-Otero; Enrique M Cabaleiro-Lago;
PUBLISHED: 2015, SOURCE: Computational and Theoretical Chemistry, VOLUME: 1053, PAGES: 123-129
332
TITLE: QSAR-based studies of nanomaterials in the environment
AUTHORS: Kleandrova, VV; Luan, F; Speck Planche, A; Cordeiro, MNDS ;
PUBLISHED: 2015, SOURCE: Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment, PAGES: 506-534
AUTHORS: Kleandrova, VV; Luan, F; Speck Planche, A; Cordeiro, MNDS ;
PUBLISHED: 2015, SOURCE: Quantitative Structure-Activity Relationships in Drug Design, Predictive Toxicology, and Risk Assessment, PAGES: 506-534
333
TITLE: Quinoxaline, its derivatives and applications: A State of the Art review Full Text
AUTHORS: Joana A Pereira; Ana M Pessoa ; Natalia N D S Cordeiro ; Ruben Fernandes; Cristina Prudencio ; Joao Paulo Noronha; Monica Vieira ;
PUBLISHED: 2015, SOURCE: EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, VOLUME: 97, PAGES: 664-672
AUTHORS: Joana A Pereira; Ana M Pessoa ; Natalia N D S Cordeiro ; Ruben Fernandes; Cristina Prudencio ; Joao Paulo Noronha; Monica Vieira ;
PUBLISHED: 2015, SOURCE: EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, VOLUME: 97, PAGES: 664-672
334
TITLE: Recent advances in multi-task QSAR modeling for drug design
AUTHORS: Halder, AK ; Goodarzi, M;
PUBLISHED: 2015, SOURCE: Pharmaceutical Sciences, VOLUME: 21, ISSUE: 4, PAGES: 175-177
AUTHORS: Halder, AK ; Goodarzi, M;
PUBLISHED: 2015, SOURCE: Pharmaceutical Sciences, VOLUME: 21, ISSUE: 4, PAGES: 175-177
INDEXED IN: Scopus 
CrossRef
Scopus CrossRef335
TITLE: Review of Structures Containing Fullerene-C-60 for Delivery of Antibacterial Agents. Multitasking Model for Computational Assessment of Safety Profiles
AUTHORS: Valeria V Kleandrova; Feng Luan; Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2015, SOURCE: CURRENT BIOINFORMATICS, VOLUME: 10, ISSUE: 5, PAGES: 565-578
AUTHORS: Valeria V Kleandrova; Feng Luan; Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2015, SOURCE: CURRENT BIOINFORMATICS, VOLUME: 10, ISSUE: 5, PAGES: 565-578
336
TITLE: Simple descriptors for assessing the outcome of aza-Diels-Alder reactions
AUTHORS: Filipe Teixeira ; Natalia, M ; Cordeiro, DS;
PUBLISHED: 2015, SOURCE: RSC ADVANCES, VOLUME: 5, ISSUE: 63, PAGES: 50729-50740
AUTHORS: Filipe Teixeira ; Natalia, M ; Cordeiro, DS;
PUBLISHED: 2015, SOURCE: RSC ADVANCES, VOLUME: 5, ISSUE: 63, PAGES: 50729-50740
337
TITLE: Sol-Gel Chemistry Applied to Medicinal Science
AUTHORS: Concu, R ; Perez, M; Azenha, M ;
PUBLISHED: 2015, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 3, PAGES: 198-198
AUTHORS: Concu, R ; Perez, M; Azenha, M ;
PUBLISHED: 2015, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 15, ISSUE: 3, PAGES: 198-198
338
TITLE: Solvent Accessible Surface Area-Based Hot-Spot Detection Methods for Protein-Protein and Protein-Nucleic Acid Interfaces Full Text
AUTHORS: Cristian R Munteanu; Antonio C Pimenta; Carlos Fernandez Lozano; Andre Melo ; Maria N D S Cordeiro ; Irina S Moreira ;
PUBLISHED: 2015, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 55, ISSUE: 5, PAGES: 1077-1086
AUTHORS: Cristian R Munteanu; Antonio C Pimenta; Carlos Fernandez Lozano; Andre Melo ; Maria N D S Cordeiro ; Irina S Moreira ;
PUBLISHED: 2015, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 55, ISSUE: 5, PAGES: 1077-1086
339
TITLE: Stepwise development of structure-activity relationship of diverse PARP-1 inhibitors through comparative and validated in silico modeling techniques and molecular dynamics simulation
AUTHORS: Halder, AK ; Saha, A; Saha, KD; Jha, T;
PUBLISHED: 2015, SOURCE: Journal of Biomolecular Structure and Dynamics, VOLUME: 33, ISSUE: 8, PAGES: 1756-1779
AUTHORS: Halder, AK ; Saha, A; Saha, KD; Jha, T;
PUBLISHED: 2015, SOURCE: Journal of Biomolecular Structure and Dynamics, VOLUME: 33, ISSUE: 8, PAGES: 1756-1779
340
TITLE: Structural findings of phenylindoles as cytotoxic antimitotic agents in human breast cancer cell lines through multiple validated QSAR studies Full Text
AUTHORS: Adhikari, N; Halder, AK ; Saha, A; Das Saha, K; Jha, T;
PUBLISHED: 2015, SOURCE: Toxicology in Vitro, VOLUME: 29, ISSUE: 7, PAGES: 1392-1404
AUTHORS: Adhikari, N; Halder, AK ; Saha, A; Das Saha, K; Jha, T;
PUBLISHED: 2015, SOURCE: Toxicology in Vitro, VOLUME: 29, ISSUE: 7, PAGES: 1392-1404
