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: 643
15 Team MembersFilters -> Year: 2025
81
TITLE: p A simple electrochemical detection of atorvastatin based on disposable screen-printed carbon electrodes modified by molecularly imprinted polymer: Experiment and simulation Full Text
AUTHORS: Rebelo, P; Pacheco, JG; Voroshylova, IV ; Melo, A ; Cordeiro, MNDS ; Delerue Matos, C ;
PUBLISHED: 2022, SOURCE: ANALYTICA CHIMICA ACTA, VOLUME: 1194, PAGES: 339410
AUTHORS: Rebelo, P; Pacheco, JG; Voroshylova, IV ; Melo, A ; Cordeiro, MNDS ; Delerue Matos, C ;
PUBLISHED: 2022, SOURCE: ANALYTICA CHIMICA ACTA, VOLUME: 1194, PAGES: 339410
82
TITLE: Predicting the Surface Tension of Deep Eutectic Solvents: A Step Forward in the Use of Greener Solvents Full Text
AUTHORS: Halder, Amit Kumar ; Haghbakhsh, Reza; Voroshylova, Iuliia V. ; Duarte, Ana Rita C.; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 15, PAGES: 4896
AUTHORS: Halder, Amit Kumar ; Haghbakhsh, Reza; Voroshylova, Iuliia V. ; Duarte, Ana Rita C.; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 15, PAGES: 4896
83
TITLE: Relating the Ambient Temperature and Ionic Liquid Structure to the Changes of Capacitance Using Molecular Dynamics
AUTHORS: Heigo Ers; Iuliia Voroshylova ; Piret Pikma; Vladislav Ivanistsev;
PUBLISHED: 2022, SOURCE: ECS Meeting Abstracts, VOLUME: MA2022-01, ISSUE: 46, PAGES: 1958-1958
AUTHORS: Heigo Ers; Iuliia Voroshylova ; Piret Pikma; Vladislav Ivanistsev;
PUBLISHED: 2022, SOURCE: ECS Meeting Abstracts, VOLUME: MA2022-01, ISSUE: 46, PAGES: 1958-1958
INDEXED IN: 
CrossRef
CrossRef84
TITLE: Synthesis, anticancer activity, SAR and binding mode of interaction studies of substituted pentanoic acids: part II
AUTHORS: Datta, S; Halder, AK ; Adhikari, N; Amin, SA; Das, S; Jha, T;
PUBLISHED: 2022, SOURCE: FUTURE MEDICINAL CHEMISTRY, VOLUME: 14, ISSUE: 1, PAGES: 17-34
AUTHORS: Datta, S; Halder, AK ; Adhikari, N; Amin, SA; Das, S; Jha, T;
PUBLISHED: 2022, SOURCE: FUTURE MEDICINAL CHEMISTRY, VOLUME: 14, ISSUE: 1, PAGES: 17-34
INDEXED IN: 
Scopus 
WOS
Scopus WOS85
TITLE: Theoretical Study on the Diels–Alder Reaction of Fullerenes: Analysis of Isomerism, Aromaticity, and Solvation
AUTHORS: Diogo J L Rodrigues; Luís M N B F Santos ; André Melo ; Carlos F R A C Lima ;
PUBLISHED: 2022, SOURCE: Organics, VOLUME: 3, ISSUE: 4, PAGES: 364-379
AUTHORS: Diogo J L Rodrigues; Luís M N B F Santos ; André Melo ; Carlos F R A C Lima ;
PUBLISHED: 2022, SOURCE: Organics, VOLUME: 3, ISSUE: 4, PAGES: 364-379
86
TITLE: Toxicity Assessment of the Binary Mixtures of Aquatic Organisms Based on Different Hypothetical Descriptors Full Text
AUTHORS: Ji, Meng; Zhang, Lihong; Zhuang, Xuming; Tian, Chunyuan; Luan, Feng; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 19, PAGES: 6389
AUTHORS: Ji, Meng; Zhang, Lihong; Zhuang, Xuming; Tian, Chunyuan; Luan, Feng; Cordeiro, Maria Natalia D. S. ;
PUBLISHED: 2022, SOURCE: MOLECULES, VOLUME: 27, ISSUE: 19, PAGES: 6389
87
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
88
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
89
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
90
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
Scopus CrossRef91
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
92
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
93
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
Scopus CrossRef94
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
Scopus CrossRef95
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
96
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
97
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
98
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
99
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
100
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
