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
101
TITLE: Turning deep-eutectic solvents into value-added products for CO2 capture: A desirability-based virtual screening study Full Text
AUTHORS: Ambure, Pravin ; Perez Castillo, Yunierkis; Halder, Amit Kumar; Cordeiro, M. Natalia D. S. ;
PUBLISHED: 2022, SOURCE: JOURNAL OF CO2 UTILIZATION, VOLUME: 58, PAGES: 101926
AUTHORS: Ambure, Pravin ; Perez Castillo, Yunierkis; Halder, Amit Kumar; Cordeiro, M. Natalia D. S. ;
PUBLISHED: 2022, SOURCE: JOURNAL OF CO2 UTILIZATION, VOLUME: 58, PAGES: 101926
102
TITLE: "Ethics against Chemistry": Solving a Crime Using Chemistry Concepts and Storytelling in a History of Science-Based Interactive Game for Middle School Students Full Text
AUTHORS: Dias, D; José Ferraz-Caetano ; Paiva, J ;
PUBLISHED: 2021, SOURCE: JOURNAL OF CHEMICAL EDUCATION, VOLUME: 98, ISSUE: 5, PAGES: 1681-1690
AUTHORS: Dias, D; José Ferraz-Caetano ; Paiva, J ;
PUBLISHED: 2021, SOURCE: JOURNAL OF CHEMICAL EDUCATION, VOLUME: 98, ISSUE: 5, PAGES: 1681-1690
103
TITLE: Advanced Materials Based on Nanosized Hydroxyapatite Full Text
AUTHORS: Ramón Rial; Michael González-Durruthy ; Zhen Liu; Juan M Ruso;
PUBLISHED: 2021, SOURCE: Molecules, VOLUME: 26, ISSUE: 11, PAGES: 3190
AUTHORS: Ramón Rial; Michael González-Durruthy ; Zhen Liu; Juan M Ruso;
PUBLISHED: 2021, SOURCE: Molecules, VOLUME: 26, ISSUE: 11, PAGES: 3190
104
TITLE: Aiming High versus Aiming All: Aquatic Toxicology and QSAR Multitarget Models. Aquatic Toxicology and QSAR Multitarget Models
AUTHORS: Moura, AS; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 167-179
AUTHORS: Moura, AS; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 167-179
INDEXED IN:
Scopus
CrossRef
CrossRef105
TITLE: AKT Inhibitors: The Road Ahead to Computational Modeling-Guided Discovery Full Text
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, VOLUME: 22, ISSUE: 8, PAGES: 3944
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, VOLUME: 22, ISSUE: 8, PAGES: 3944
106
TITLE: Chapter 11: Supported Vanadium Catalysts: Heterogeneous Molecular Complexes, Electrocatalysis and Biomass Transformation
AUTHORS: cristina freire ; Clara Pereira ; Jarrais, B; Fernandes, D ; Andreia F. Peixoto ; Cordeiro, N ; Teixeira, F ;
PUBLISHED: 2021, SOURCE: RSC Catalysis Series, VOLUME: 2021-January, ISSUE: 41, PAGES: 241-284
AUTHORS: cristina freire ; Clara Pereira ; Jarrais, B; Fernandes, D ; Andreia F. Peixoto ; Cordeiro, N ; Teixeira, F ;
PUBLISHED: 2021, SOURCE: RSC Catalysis Series, VOLUME: 2021-January, ISSUE: 41, PAGES: 241-284
107
TITLE: Chemistry edutainment: A storytelling activity for middle-school children. A Storytelling Activity for Middle-School Children
AUTHORS: José Ferraz-Caetano ; Dias, D;
PUBLISHED: 2021, SOURCE: Handbook of Research on Contemporary Storytelling Methods Across New Media and Disciplines, PAGES: 364-391
AUTHORS: José Ferraz-Caetano ; Dias, D;
PUBLISHED: 2021, SOURCE: Handbook of Research on Contemporary Storytelling Methods Across New Media and Disciplines, PAGES: 364-391
INDEXED IN:
Scopus
CrossRef
CrossRef108
TITLE: Chemometric Modeling of Daphnia Toxicity
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 293-317
AUTHORS: Halder, AK ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: Chemometrics and Cheminformatics in Aquatic Toxicology, PAGES: 293-317
INDEXED IN:
Scopus
CrossRef
CrossRef109
TITLE: Computational Biology: A New Frontier in Applied Biology
AUTHORS: Toma, M; Concu, R ;
PUBLISHED: 2021, SOURCE: BIOLOGY-BASEL, VOLUME: 10, ISSUE: 5, PAGES: 374
AUTHORS: Toma, M; Concu, R ;
PUBLISHED: 2021, SOURCE: BIOLOGY-BASEL, VOLUME: 10, ISSUE: 5, PAGES: 374
110
TITLE: Databases for the study of biofilms: current status and potential applications Full Text
AUTHORS: Martins, FG; Melo, A ; Sérgio F. Sousa ;
PUBLISHED: 2021, SOURCE: BIOFOULING, VOLUME: 37, ISSUE: 1, PAGES: 96-108
AUTHORS: Martins, FG; Melo, A ; Sérgio F. Sousa ;
PUBLISHED: 2021, SOURCE: BIOFOULING, VOLUME: 37, ISSUE: 1, PAGES: 96-108
111
TITLE: Density of Deep Eutectic Solvents: The Path Forward Cheminformatics-Driven Reliable Predictions for Mixtures Full Text
AUTHORS: Halder, AK ; Haghbakhsh, R; Voroshylova, IV ; Duarte, ARC; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: MOLECULES, VOLUME: 26, ISSUE: 19, PAGES: 5779
AUTHORS: Halder, AK ; Haghbakhsh, R; Voroshylova, IV ; Duarte, ARC; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: MOLECULES, VOLUME: 26, ISSUE: 19, PAGES: 5779
112
TITLE: Development of a molecular imprinted electrochemiluminescence sensor for amitriptyline detection: From MD simulations to experimental implementation Full Text
AUTHORS: Rebelo, P; Pacheco, JG; Voroshylova, IV ; Cordeiro, MNDS ; Delerue Matos, C ;
PUBLISHED: 2021, SOURCE: ELECTROCHIMICA ACTA, VOLUME: 397, PAGES: 139273
AUTHORS: Rebelo, P; Pacheco, JG; Voroshylova, IV ; Cordeiro, MNDS ; Delerue Matos, C ;
PUBLISHED: 2021, SOURCE: ELECTROCHIMICA ACTA, VOLUME: 397, PAGES: 139273
113
TITLE: Discovery of Cyanobacterial Natural Products Containing Fatty Acid Residues** Full Text
AUTHORS: Figueiredo, SAC; Preto, M; Moreira, G ; Martins, TP; Abt, K; Melo, A ; Vasconcelos, VM ; Leao, PN ;
PUBLISHED: 2021, SOURCE: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, VOLUME: 60, ISSUE: 18, PAGES: 10064-10072
AUTHORS: Figueiredo, SAC; Preto, M; Moreira, G ; Martins, TP; Abt, K; Melo, A ; Vasconcelos, VM ; Leao, PN ;
PUBLISHED: 2021, SOURCE: ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, VOLUME: 60, ISSUE: 18, PAGES: 10064-10072
114
TITLE: Exploring the conformational binding mechanism of fibrinogen induced by interactions with penicillin beta-lactam antibiotic drugs Full Text
AUTHORS: Gonzalez Durruthy, M ; Rial, R; Cordeiro, MNDS ; Liu, Z; Ruso, JM;
PUBLISHED: 2021, SOURCE: JOURNAL OF MOLECULAR LIQUIDS, VOLUME: 324, PAGES: 114667
AUTHORS: Gonzalez Durruthy, M ; Rial, R; Cordeiro, MNDS ; Liu, Z; Ruso, JM;
PUBLISHED: 2021, SOURCE: JOURNAL OF MOLECULAR LIQUIDS, VOLUME: 324, PAGES: 114667
115
TITLE: First-principles-based kinetic Monte Carlo simulations of CO oxidation on catalytic Au(110) and Ag(110) surfaces Full Text
AUTHORS: Fajin, JLC ; Moura, AS ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 23, ISSUE: 25, PAGES: 14037-14050
AUTHORS: Fajin, JLC ; Moura, AS ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 23, ISSUE: 25, PAGES: 14037-14050
116
TITLE: Heavy metal ion separation from industrial wastewater using stacked graphene Membranes: A molecular dynamics simulation study Full Text
AUTHORS: Giri, AK; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: JOURNAL OF MOLECULAR LIQUIDS, VOLUME: 338, PAGES: 116688
AUTHORS: Giri, AK; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: JOURNAL OF MOLECULAR LIQUIDS, VOLUME: 338, PAGES: 116688
117
TITLE: Identification of New Potential Inhibitors of Quorum Sensing through a Specialized Multi-Level Computational Approach Full Text
AUTHORS: Martins, FG; Melo, A ; Sérgio F. Sousa ;
PUBLISHED: 2021, SOURCE: MOLECULES, VOLUME: 26, ISSUE: 9, PAGES: 2600
AUTHORS: Martins, FG; Melo, A ; Sérgio F. Sousa ;
PUBLISHED: 2021, SOURCE: MOLECULES, VOLUME: 26, ISSUE: 9, PAGES: 2600
118
TITLE: Insights into the catalytic activity of trimetallic Al/Zn/Cu surfaces for the water gas shift reaction Full Text
AUTHORS: Fajin, JLC ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: APPLIED SURFACE SCIENCE, VOLUME: 542, PAGES: 148589
AUTHORS: Fajin, JLC ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: APPLIED SURFACE SCIENCE, VOLUME: 542, PAGES: 148589
119
TITLE: Ionic liquid-metal interface: The origins of capacitance peaks Full Text
AUTHORS: Voroshylova, IV ; Ers, H; Koverga, V; Docampo Alvarez, B; Pikma, P; Ivanistsev, VB; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: ELECTROCHIMICA ACTA, VOLUME: 379, PAGES: 138148
AUTHORS: Voroshylova, IV ; Ers, H; Koverga, V; Docampo Alvarez, B; Pikma, P; Ivanistsev, VB; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: ELECTROCHIMICA ACTA, VOLUME: 379, PAGES: 138148
120
TITLE: Light alcohols reforming towards renewable hydrogen production on multicomponent catalysts Full Text
AUTHORS: Fajin, JLC ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: RENEWABLE & SUSTAINABLE ENERGY REVIEWS, VOLUME: 138, PAGES: 110523
AUTHORS: Fajin, JLC ; Cordeiro, MNDS ;
PUBLISHED: 2021, SOURCE: RENEWABLE & SUSTAINABLE ENERGY REVIEWS, VOLUME: 138, PAGES: 110523