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
501
TITLE: Critical Assessment of Methods for the Intrinsic Analysis of Liquid Interfaces: 2. Density Profiles
AUTHORS: Miguel Jorge; Gyoergy Hantal; Pal Jedlovszky; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 114, ISSUE: 43, PAGES: 18656-18663
AUTHORS: Miguel Jorge; Gyoergy Hantal; Pal Jedlovszky; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 114, ISSUE: 43, PAGES: 18656-18663
502
TITLE: Descriptors controlling the catalytic activity of metallic surfaces toward water splitting Full Text
AUTHORS: Jose L C Fajin ; Natalia N D S Cordeiro ; Francesc Illas; Jose R B Gomes ;
PUBLISHED: 2010, SOURCE: JOURNAL OF CATALYSIS, VOLUME: 276, ISSUE: 1, PAGES: 92-100
AUTHORS: Jose L C Fajin ; Natalia N D S Cordeiro ; Francesc Illas; Jose R B Gomes ;
PUBLISHED: 2010, SOURCE: JOURNAL OF CATALYSIS, VOLUME: 276, ISSUE: 1, PAGES: 92-100
503
TITLE: Design of carbocyclic nucleosides with antineoplastic activity Full Text
AUTHORS: Aliuska M Morales Helguera; Natalia N D S Cordeiro ; Rodriguez Borges, JE ; Xerardo Garcia Mera; Maykel P Perez Gonzalez; Yunierkis P Perez Castillo;
PUBLISHED: 2010, SOURCE: PURINERGIC SIGNALLING, VOLUME: 6, ISSUE: 1, PAGES: 99-100
AUTHORS: Aliuska M Morales Helguera; Natalia N D S Cordeiro ; Rodriguez Borges, JE ; Xerardo Garcia Mera; Maykel P Perez Gonzalez; Yunierkis P Perez Castillo;
PUBLISHED: 2010, SOURCE: PURINERGIC SIGNALLING, VOLUME: 6, ISSUE: 1, PAGES: 99-100
INDEXED IN: 
WOS
WOS504
TITLE: Design, Synthesis, and Evaluation of Antineoplastic Activity of Novel Carbocyclic Nucleosides Full Text
AUTHORS: Aliuska M Helguera; Rodriguez Borges, JE ; Olga Caamano; Xerardo Garcia Mera; Maykel P Perez Gonzalez; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: MOLECULAR INFORMATICS, VOLUME: 29, ISSUE: 3, PAGES: 213-231
AUTHORS: Aliuska M Helguera; Rodriguez Borges, JE ; Olga Caamano; Xerardo Garcia Mera; Maykel P Perez Gonzalez; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: MOLECULAR INFORMATICS, VOLUME: 29, ISSUE: 3, PAGES: 213-231
505
TITLE: Desirability-based simultaneous analysis of binding and relative efficacy profiles of A(3) adenosine receptor agonists Full Text
AUTHORS: Cruz Monteagudo, M; Cordeiro, MNDS ; Teijeira, M; Gonzalez, MP; Borges, F ;
PUBLISHED: 2010, SOURCE: PURINERGIC SIGNALLING, VOLUME: 6, ISSUE: 1, PAGES: 72-73
AUTHORS: Cruz Monteagudo, M; Cordeiro, MNDS ; Teijeira, M; Gonzalez, MP; Borges, F ;
PUBLISHED: 2010, SOURCE: PURINERGIC SIGNALLING, VOLUME: 6, ISSUE: 1, PAGES: 72-73
INDEXED IN: WOS
WOS506
TITLE: DFT study on the reaction of NO oxidation on a stepped gold surface Full Text
AUTHORS: Jose L C Fajin ; Natalia N D S Cordeiro ; Jose R B Gomes ;
PUBLISHED: 2010, SOURCE: APPLIED CATALYSIS A-GENERAL, VOLUME: 379, ISSUE: 1-2, PAGES: 111-120
AUTHORS: Jose L C Fajin ; Natalia N D S Cordeiro ; Jose R B Gomes ;
PUBLISHED: 2010, SOURCE: APPLIED CATALYSIS A-GENERAL, VOLUME: 379, ISSUE: 1-2, PAGES: 111-120
507
TITLE: Energy decomposition analysis of cis and trans isomers of 1,2-dihaloethylenes and 2-butene Full Text
AUTHORS: Zenaida Sobral Mourao ; Andre Melo ;
PUBLISHED: 2010, SOURCE: 9th National Meeting of Physical Chemistry in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 946, ISSUE: 1-3, PAGES: 7-12
AUTHORS: Zenaida Sobral Mourao ; Andre Melo ;
PUBLISHED: 2010, SOURCE: 9th National Meeting of Physical Chemistry in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 946, ISSUE: 1-3, PAGES: 7-12
508
TITLE: Long-Term Follow-Up of Breast Capsule Contracture Rates in Cosmetic and Reconstructive Cases
AUTHORS: Marques, M ; Brown, SA; Oliveira, I; Cordeiro, MNDS ; Morales Helguera, A; Rodrigues, A ; Amarante, J ;
PUBLISHED: 2010, SOURCE: PLASTIC AND RECONSTRUCTIVE SURGERY, VOLUME: 126, ISSUE: 3, PAGES: 769-778
AUTHORS: Marques, M ; Brown, SA; Oliveira, I; Cordeiro, MNDS ; Morales Helguera, A; Rodrigues, A ; Amarante, J ;
PUBLISHED: 2010, SOURCE: PLASTIC AND RECONSTRUCTIVE SURGERY, VOLUME: 126, ISSUE: 3, PAGES: 769-778
509
TITLE: Multidimensional Drug Design: Simultaneous Analysis of Binding and Relative Efficacy Profiles of N6-substituted-4'-thioadenosines A(3) Adenosine Receptor Agonists. Multidimensional Drug Design Full Text
AUTHORS: Cruz Monteagudo, M ; Cordeiro, MNDS ; Teijeira, M; Gonzalez, MP; Borges, F ;
PUBLISHED: 2010, SOURCE: CHEMICAL BIOLOGY & DRUG DESIGN, VOLUME: 75, ISSUE: 6, PAGES: 607-618
AUTHORS: Cruz Monteagudo, M ; Cordeiro, MNDS ; Teijeira, M; Gonzalez, MP; Borges, F ;
PUBLISHED: 2010, SOURCE: CHEMICAL BIOLOGY & DRUG DESIGN, VOLUME: 75, ISSUE: 6, PAGES: 607-618
510
TITLE: On the Stability of Metal-Aminoacid Complexes in Water Based on Water-Ligand Exchange Reactions and Electronic Properties: Detailed Study on Iron-Glycine Hexacoordinated Complexes Full Text
AUTHORS: Marcos Mandado; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF COMPUTATIONAL CHEMISTRY, VOLUME: 31, ISSUE: 15, PAGES: 2735-2745
AUTHORS: Marcos Mandado; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: JOURNAL OF COMPUTATIONAL CHEMISTRY, VOLUME: 31, ISSUE: 15, PAGES: 2735-2745
511
TITLE: Prioritizing Hits with Appropriate Trade-Offs Between HIV-1 Reverse Transcriptase Inhibitory Efficacy and MT4 Blood Cells Toxicity Through Desirability-Based Multiobjective Optimization and Ranking Full Text
AUTHORS: Cruz Monteagudo, M ; PhamThe, H; Cordeiro, MNDS ; Borges, F ;
PUBLISHED: 2010, SOURCE: MOLECULAR INFORMATICS, VOLUME: 29, ISSUE: 4, PAGES: 303-321
AUTHORS: Cruz Monteagudo, M ; PhamThe, H; Cordeiro, MNDS ; Borges, F ;
PUBLISHED: 2010, SOURCE: MOLECULAR INFORMATICS, VOLUME: 29, ISSUE: 4, PAGES: 303-321
512
TITLE: QSAR models to predict mutagenicity of acrylates, methacrylates and alpha,beta-unsaturated carbonyl compounds Full Text
AUTHORS: Alfonso Perez Garrido; Aliuska M Morales Helguera; Francisco G Giron Rodriguez; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: DENTAL MATERIALS, VOLUME: 26, ISSUE: 5, PAGES: 397-415
AUTHORS: Alfonso Perez Garrido; Aliuska M Morales Helguera; Francisco G Giron Rodriguez; Natalia N D S Cordeiro ;
PUBLISHED: 2010, SOURCE: DENTAL MATERIALS, VOLUME: 26, ISSUE: 5, PAGES: 397-415
513
TITLE: Quantitative structure-activity relationship modelling of the carcinogenic risk of nitroso compounds using regression analysis and the TOPS-MODE approach Full Text
AUTHORS: Helguera, AM; Perez Machado, G; Cordeiro, MNDS ; Combes, RD;
PUBLISHED: 2010, SOURCE: SAR AND QSAR IN ENVIRONMENTAL RESEARCH, VOLUME: 21, ISSUE: 3-4, PAGES: 277-304
AUTHORS: Helguera, AM; Perez Machado, G; Cordeiro, MNDS ; Combes, RD;
PUBLISHED: 2010, SOURCE: SAR AND QSAR IN ENVIRONMENTAL RESEARCH, VOLUME: 21, ISSUE: 3-4, PAGES: 277-304
514
TITLE: Quantum Semiempirical Energy Based (SEEB) Descriptors Performance with Benzamidine Inhibitors of Trypsin Full Text
AUTHORS: Alexandre R F Carvalho ; Andre Melo ;
PUBLISHED: 2010, SOURCE: MOLECULAR INFORMATICS, VOLUME: 29, ISSUE: 6-7, PAGES: 525-531
AUTHORS: Alexandre R F Carvalho ; Andre Melo ;
PUBLISHED: 2010, SOURCE: MOLECULAR INFORMATICS, VOLUME: 29, ISSUE: 6-7, PAGES: 525-531
515
TITLE: Review of MARCH-INSIDE & Complex Networks Prediction of Drugs: ADMET, Anti-parasite Activity, Metabolizing Enzymes and Cardiotoxicity Proteome Biomarkers
AUTHORS: Humberto Gonzalez-Diaz; Aliuska Duardo-Sanchez; Florencio M. Ubeira; Francisco Prado-Prado; Lazaro G. Perez-Montoto; Concu, R ; Gianni Podda; Bairong Shen;
PUBLISHED: 2010, SOURCE: Current Drug Metabolism, VOLUME: 11, ISSUE: 4, PAGES: 379-406
AUTHORS: Humberto Gonzalez-Diaz; Aliuska Duardo-Sanchez; Florencio M. Ubeira; Francisco Prado-Prado; Lazaro G. Perez-Montoto; Concu, R ; Gianni Podda; Bairong Shen;
PUBLISHED: 2010, SOURCE: Current Drug Metabolism, VOLUME: 11, ISSUE: 4, PAGES: 379-406
516
TITLE: Review of QSAR Models for Enzyme Classes of Drug Targets: Theoretical Background and Applications in Parasites, Hosts and Other Organisms
AUTHORS: Riccardo Concu ; Gianni Podda; Florencio M. Ubeira; Humberto Gonzalez-Diaz;
PUBLISHED: 2010, SOURCE: Current Pharmaceutical Design, VOLUME: 16, ISSUE: 24, PAGES: 2710-2723
AUTHORS: Riccardo Concu ; Gianni Podda; Florencio M. Ubeira; Humberto Gonzalez-Diaz;
PUBLISHED: 2010, SOURCE: Current Pharmaceutical Design, VOLUME: 16, ISSUE: 24, PAGES: 2710-2723
517
TITLE: Structural findings of 2-Phenylindole-3-carbaldehyde derivatives for antimitotic activity by FA-sMLR QSAR analysis Full Text
AUTHORS: Halder, AK ; Adhikari, N; Jha, T;
PUBLISHED: 2010, SOURCE: Chemical Biology and Drug Design, VOLUME: 75, ISSUE: 2, PAGES: 204-213
AUTHORS: Halder, AK ; Adhikari, N; Jha, T;
PUBLISHED: 2010, SOURCE: Chemical Biology and Drug Design, VOLUME: 75, ISSUE: 2, PAGES: 204-213
518
TITLE: Structure of the interface between water and self-assembled monolayers of neutral, anionic and cationic alkane thiols
AUTHORS: Szefczyk, B ; Franco, R ; Gomes, JANF ; Cordeiro, MNDS ;
PUBLISHED: 2010, SOURCE: 9th National Meeting of Physical Chemistry in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 946, ISSUE: 1-3, PAGES: 83-87
AUTHORS: Szefczyk, B ; Franco, R ; Gomes, JANF ; Cordeiro, MNDS ;
PUBLISHED: 2010, SOURCE: 9th National Meeting of Physical Chemistry in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 946, ISSUE: 1-3, PAGES: 83-87
519
TITLE: Synthesis, pharmacological activity and comparative QSAR modeling of 1,5-N,N′-substituted-2-(substituted naphthalenesulphonyl) glutamamides as possible anticancer agents Full Text
AUTHORS: Halder, AK ; Adhikary, N; Maity, MK; Jha, T;
PUBLISHED: 2010, SOURCE: European Journal of Medicinal Chemistry, VOLUME: 45, ISSUE: 5, PAGES: 1760-1771
AUTHORS: Halder, AK ; Adhikary, N; Maity, MK; Jha, T;
PUBLISHED: 2010, SOURCE: European Journal of Medicinal Chemistry, VOLUME: 45, ISSUE: 5, PAGES: 1760-1771
520
TITLE: The phenomenological account for electronic polarization in ionic liquid
AUTHORS: Vitaly V Chaban; Iuliia V Voroshylova ; Oleg N Kalugin;
PUBLISHED: 2010, SOURCE: ECS Transactions, VOLUME: 33, ISSUE: 28, PAGES: 43-55
AUTHORS: Vitaly V Chaban; Iuliia V Voroshylova ; Oleg N Kalugin;
PUBLISHED: 2010, SOURCE: ECS Transactions, VOLUME: 33, ISSUE: 28, PAGES: 43-55
