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: 608
15 Team MembersFilters -> Year: 2025
541
TITLE: beta-nitrostyrene derivatives as potential antibacterial agents: A structure-property-activity relationship study
AUTHORS: Milhazes, N ; Calheiros, R; Marques, MPM ; Garrido, J ; Cordeiro, MNDS ; Rodrigues, C; Quinteira, S ; Novais, C ; Peixe, L ; Borges, F ;
PUBLISHED: 2006, SOURCE: Bioorganic & Medicinal Chemistry in BIOORGANIC & MEDICINAL CHEMISTRY, VOLUME: 14, ISSUE: 12, PAGES: 4078-4088
AUTHORS: Milhazes, N ; Calheiros, R; Marques, MPM ; Garrido, J ; Cordeiro, MNDS ; Rodrigues, C; Quinteira, S ; Novais, C ; Peixe, L ; Borges, F ;
PUBLISHED: 2006, SOURCE: Bioorganic & Medicinal Chemistry in BIOORGANIC & MEDICINAL CHEMISTRY, VOLUME: 14, ISSUE: 12, PAGES: 4078-4088
542
TITLE: Catanionic surfactant films at the air-water interface Full Text
AUTHORS: Yujie J Wang; Carlos M Pereira ; Eduardo F Marques ; Rodrigo O Brito; Ferreira, ES ; Silva, F ;
PUBLISHED: 2006, SOURCE: THIN SOLID FILMS, VOLUME: 515, ISSUE: 4, PAGES: 2031-2037
AUTHORS: Yujie J Wang; Carlos M Pereira ; Eduardo F Marques ; Rodrigo O Brito; Ferreira, ES ; Silva, F ;
PUBLISHED: 2006, SOURCE: THIN SOLID FILMS, VOLUME: 515, ISSUE: 4, PAGES: 2031-2037
543
TITLE: Electrochemistry of 2,8-dithia[9],(2,9)-1,10-phenanthrolinophane (L) at the polarized water/1, 2-dichloroethane interface: Evaluation of the complexation properties towards transition and post-transition metal ions Full Text
AUTHORS: Ferreira, ES ; Garau, A; Lippolis, V; Pereira, CM ; Silva, F ;
PUBLISHED: 2006, SOURCE: JOURNAL OF ELECTROANALYTICAL CHEMISTRY, VOLUME: 587, ISSUE: 1, PAGES: 155-160
AUTHORS: Ferreira, ES ; Garau, A; Lippolis, V; Pereira, CM ; Silva, F ;
PUBLISHED: 2006, SOURCE: JOURNAL OF ELECTROANALYTICAL CHEMISTRY, VOLUME: 587, ISSUE: 1, PAGES: 155-160
544
TITLE: Molecular dynamics study of 2-nitrophenyl octyl ether and nitrobenzene
AUTHORS: Jorge, M; Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ;
PUBLISHED: 2006, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 110, ISSUE: 25, PAGES: 12530-12538
AUTHORS: Jorge, M; Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ;
PUBLISHED: 2006, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 110, ISSUE: 25, PAGES: 12530-12538
545
TITLE: Molecular dynamics study of nitrobenzene and 2-nitrophenyloctyl ether saturated with water Full Text
AUTHORS: Jorge, M; Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ;
PUBLISHED: 2006, SOURCE: 7th Liblice Conference on Statistical Mechanics of Liquids in MOLECULAR PHYSICS, VOLUME: 104, ISSUE: 22-24, PAGES: 3627-3634
AUTHORS: Jorge, M; Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ;
PUBLISHED: 2006, SOURCE: 7th Liblice Conference on Statistical Mechanics of Liquids in MOLECULAR PHYSICS, VOLUME: 104, ISSUE: 22-24, PAGES: 3627-3634
546
TITLE: Molecular interactions between human cytochrome P450 1A2 and flavone derivatives
AUTHORS: da Fonseca, R; Melo, A ; Iori, F; Menziani, C; Ramos, MJ ;
PUBLISHED: 2006, SOURCE: Medicinal Chemistry, VOLUME: 2, ISSUE: 4, PAGES: 401-406
AUTHORS: da Fonseca, R; Melo, A ; Iori, F; Menziani, C; Ramos, MJ ;
PUBLISHED: 2006, SOURCE: Medicinal Chemistry, VOLUME: 2, ISSUE: 4, PAGES: 401-406
INDEXED IN: 
Scopus 
CrossRef
Scopus CrossRef547
TITLE: The p-difluorobenzene-argon S-1 excited state intermolecular potential energy surface
AUTHORS: Jose Luis C Cagide Fajin ; Berta Fernandez; Peter M Felker;
PUBLISHED: 2006, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY A, VOLUME: 110, ISSUE: 49, PAGES: 13259-13263
AUTHORS: Jose Luis C Cagide Fajin ; Berta Fernandez; Peter M Felker;
PUBLISHED: 2006, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY A, VOLUME: 110, ISSUE: 49, PAGES: 13259-13263
INDEXED IN: Scopus 
WOS
Scopus WOS548
TITLE: Unusual solvent effect on a S(N)2 reaction. A quantum-mechanical and kinetic study of the Menshutkin reaction between 2-amino-1-methylbenzimidazole and iodomethane in the gas phase and in acetonitrile
AUTHORS: Melo, A ; Alfaia, AJI ; Reis, JCR ; Calado, ART;
PUBLISHED: 2006, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 110, ISSUE: 4, PAGES: 1877-1888
AUTHORS: Melo, A ; Alfaia, AJI ; Reis, JCR ; Calado, ART;
PUBLISHED: 2006, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 110, ISSUE: 4, PAGES: 1877-1888
549
TITLE: Computational Insight into Anti-mutagenic Properties of CYP1A Flavonoid Ligands
AUTHORS: Rute da Fonseca; Michele Marini; Andre Melo ; Maria Cristina Menziani; Maria Joao Ramos ;
PUBLISHED: 2005, SOURCE: MEDICINAL CHEMISTRY, VOLUME: 1, ISSUE: 4, PAGES: 355-360
AUTHORS: Rute da Fonseca; Michele Marini; Andre Melo ; Maria Cristina Menziani; Maria Joao Ramos ;
PUBLISHED: 2005, SOURCE: MEDICINAL CHEMISTRY, VOLUME: 1, ISSUE: 4, PAGES: 355-360
550
TITLE: Electrochemical study of ion transfer of acetylcholine across the interface of water and a lipid-modified 1,2-dichloroethane
AUTHORS: Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ; Bogeski, I; Ferreira, E ; Ribeiro, D; Chirea, M ; Silva, AF ;
PUBLISHED: 2005, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 109, ISSUE: 25, PAGES: 12549-12559
AUTHORS: Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ; Bogeski, I; Ferreira, E ; Ribeiro, D; Chirea, M ; Silva, AF ;
PUBLISHED: 2005, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 109, ISSUE: 25, PAGES: 12549-12559
551
TITLE: Energy partitioning in association processes Full Text
AUTHORS: Carvalho, ARF ; Melo, A ;
PUBLISHED: 2005, SOURCE: 8th Annual Meeting of the V-A-Fock-School on Quantum and Computational Chemistry in INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, VOLUME: 104, ISSUE: 2, PAGES: 240-248
AUTHORS: Carvalho, ARF ; Melo, A ;
PUBLISHED: 2005, SOURCE: 8th Annual Meeting of the V-A-Fock-School on Quantum and Computational Chemistry in INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, VOLUME: 104, ISSUE: 2, PAGES: 240-248
552
TITLE: Enzymatic formation of ions and their detection at a three-phase electrode Full Text
AUTHORS: Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ; Bogeski, I; Silva, F ;
PUBLISHED: 2005, SOURCE: JOURNAL OF SOLID STATE ELECTROCHEMISTRY, VOLUME: 9, ISSUE: 6, PAGES: 469-474
AUTHORS: Gulaboski, R; Pereira, CM ; Cordeiro, MNDS ; Bogeski, I; Silva, F ;
PUBLISHED: 2005, SOURCE: JOURNAL OF SOLID STATE ELECTROCHEMISTRY, VOLUME: 9, ISSUE: 6, PAGES: 469-474
553
TITLE: Experimental and DFT study of the aza-Diels-Alder reaction between cyclopentadiene and protonated benzylimine derivated from glyoxylates Full Text
AUTHORS: Rodriguez Borges, JE ; Garcia Mera, X; Fernandez, F; Lopes, VHC; Magalhaes, AL ; Cordeiro, MNDS ;
PUBLISHED: 2005, SOURCE: TETRAHEDRON, VOLUME: 61, ISSUE: 46, PAGES: 10951-10957
AUTHORS: Rodriguez Borges, JE ; Garcia Mera, X; Fernandez, F; Lopes, VHC; Magalhaes, AL ; Cordeiro, MNDS ;
PUBLISHED: 2005, SOURCE: TETRAHEDRON, VOLUME: 61, ISSUE: 46, PAGES: 10951-10957
554
TITLE: Molecular dynamics simulations of angiotensin II in aqueous and dimethyl sulfoxide environments
AUTHORS: Preto, MAC; Melo, A ; Maia, HLS; Mavromoustakos, T; Ramos, MJ ;
PUBLISHED: 2005, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 109, ISSUE: 37, PAGES: 17743-17751
AUTHORS: Preto, MAC; Melo, A ; Maia, HLS; Mavromoustakos, T; Ramos, MJ ;
PUBLISHED: 2005, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY B, VOLUME: 109, ISSUE: 37, PAGES: 17743-17751
555
TITLE: p-difluorobenzene-argon ground state intermolecular potential energy surface
AUTHORS: Fajin, JLC ; Fernandez, B; Felker, PM;
PUBLISHED: 2005, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY A, VOLUME: 109, ISSUE: 50, PAGES: 11602-11608
AUTHORS: Fajin, JLC ; Fernandez, B; Felker, PM;
PUBLISHED: 2005, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY A, VOLUME: 109, ISSUE: 50, PAGES: 11602-11608
556
TITLE: Special issue: A collection of papers presented at the 30th international congress of theoretical chemists of Latin Expression, Porto, Portugal, 8-12 September 2004 - Foreword Full Text
AUTHORS: Ramos, MJ ; Magalhaes, AL ; Melo, AS ; Fernandes, PA ;
PUBLISHED: 2005, SOURCE: JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 729, ISSUE: 1-2
AUTHORS: Ramos, MJ ; Magalhaes, AL ; Melo, AS ; Fernandes, PA ;
PUBLISHED: 2005, SOURCE: JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, VOLUME: 729, ISSUE: 1-2
557
TITLE: Accurate intermolecular ground state potential of the Ne-HCl van der Waals complex Full Text
AUTHORS: Fajin, JLC ; Cacheiro, JL; Fernandez, B;
PUBLISHED: 2004, SOURCE: JOURNAL OF CHEMICAL PHYSICS, VOLUME: 121, ISSUE: 10, PAGES: 4599-4604
AUTHORS: Fajin, JLC ; Cacheiro, JL; Fernandez, B;
PUBLISHED: 2004, SOURCE: JOURNAL OF CHEMICAL PHYSICS, VOLUME: 121, ISSUE: 10, PAGES: 4599-4604
558
TITLE: Fermi resonance coupling in the C-H stretching region of methoxide adsorbed on clean Ru(001): a combined RAIRS and theoretical study Full Text
AUTHORS: Pinto, ASS; de Barros, RB; Cordeiro, MNDS ; Gomes, JANF ; Garcia, AR; Ilharco, LM ;
PUBLISHED: 2004, SOURCE: 22nd European Conference on Surface Science (ECOSS 22) in SURFACE SCIENCE, VOLUME: 566, ISSUE: 1-3 PART 2, PAGES: 965-970
AUTHORS: Pinto, ASS; de Barros, RB; Cordeiro, MNDS ; Gomes, JANF ; Garcia, AR; Ilharco, LM ;
PUBLISHED: 2004, SOURCE: 22nd European Conference on Surface Science (ECOSS 22) in SURFACE SCIENCE, VOLUME: 566, ISSUE: 1-3 PART 2, PAGES: 965-970
559
TITLE: Fluorobenzene-argon ground-state intermolecular potential energy surface Full Text
AUTHORS: Fajin, JLC ; Cacheiro, JL; Fernandez, B; Makarewicz, J;
PUBLISHED: 2004, SOURCE: JOURNAL OF CHEMICAL PHYSICS, VOLUME: 120, ISSUE: 18, PAGES: 8582-8586
AUTHORS: Fajin, JLC ; Cacheiro, JL; Fernandez, B; Makarewicz, J;
PUBLISHED: 2004, SOURCE: JOURNAL OF CHEMICAL PHYSICS, VOLUME: 120, ISSUE: 18, PAGES: 8582-8586
560
TITLE: Modeling chemical and biological systems: A successful course for undergraduate students Full Text
AUTHORS: Ramos, MJ ; Fernandes, PA ; Melo, A ;
PUBLISHED: 2004, SOURCE: JOURNAL OF CHEMICAL EDUCATION, VOLUME: 81, ISSUE: 1, PAGES: 72-75
AUTHORS: Ramos, MJ ; Fernandes, PA ; Melo, A ;
PUBLISHED: 2004, SOURCE: JOURNAL OF CHEMICAL EDUCATION, VOLUME: 81, ISSUE: 1, PAGES: 72-75
