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: 607
15 Team MembersFilters -> Year: 2024
361
TITLE: Evolution of Graph Theory-Based QSAR Methods and their Applications to the Search for New Antibacterial Agents
AUTHORS: Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2013, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 24, PAGES: 3101-3117
AUTHORS: Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2013, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 24, PAGES: 3101-3117
362
TITLE: Exploration of structural and physicochemical requirements and search of virtual hits for aminopeptidase N inhibitors Full Text
AUTHORS: Halder, AK ; Saha, A; Jha, T;
PUBLISHED: 2013, SOURCE: Molecular Diversity, VOLUME: 17, ISSUE: 1, PAGES: 123-137
AUTHORS: Halder, AK ; Saha, A; Jha, T;
PUBLISHED: 2013, SOURCE: Molecular Diversity, VOLUME: 17, ISSUE: 1, PAGES: 123-137
363
TITLE: Exploring QSAR and pharmacophore mapping of structurally diverse selective matrix metalloproteinase-2 inhibitors. Exploring QSAR of MMP-2 inhibitors Full Text
AUTHORS: Halder, AK ; Saha, A; Jha, T;
PUBLISHED: 2013, SOURCE: Journal of Pharmacy and Pharmacology, VOLUME: 65, ISSUE: 10, PAGES: 1541-1554
AUTHORS: Halder, AK ; Saha, A; Jha, T;
PUBLISHED: 2013, SOURCE: Journal of Pharmacy and Pharmacology, VOLUME: 65, ISSUE: 10, PAGES: 1541-1554
364
TITLE: Exploring structural requirements of aurone derivatives as antimalarials by validated DFT-based QSAR, HQSAR, and COMFA-COMSIA approach Full Text
AUTHORS: Adhikari, N; Halder, AK ; Mondal, C; Jha, T;
PUBLISHED: 2013, SOURCE: Medicinal Chemistry Research, VOLUME: 22, ISSUE: 12, PAGES: 6029-6045
AUTHORS: Adhikari, N; Halder, AK ; Mondal, C; Jha, T;
PUBLISHED: 2013, SOURCE: Medicinal Chemistry Research, VOLUME: 22, ISSUE: 12, PAGES: 6029-6045
365
TITLE: Ligand based validated comparative chemometric modeling and pharmacophore mapping of aurone derivatives as antimalarial agents
AUTHORS: Adhikari, N; Halder, AK ; Mondal, C; Jha, T;
PUBLISHED: 2013, SOURCE: Current Computer-Aided Drug Design, VOLUME: 9, ISSUE: 3, PAGES: 417-432
AUTHORS: Adhikari, N; Halder, AK ; Mondal, C; Jha, T;
PUBLISHED: 2013, SOURCE: Current Computer-Aided Drug Design, VOLUME: 9, ISSUE: 3, PAGES: 417-432
366
TITLE: Mechanism of aziridination of styrene catalyzed by copper(I) bis(oxazoline) Full Text
AUTHORS: Merced Montero Campillo, MM; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, VOLUME: 113, ISSUE: 16, PAGES: 2002-2011
AUTHORS: Merced Montero Campillo, MM; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, VOLUME: 113, ISSUE: 16, PAGES: 2002-2011
367
TITLE: Model for High-Throughput Screening of Multitarget Drugs in Chemical Neurosciences: Synthesis, Assay, and Theoretic Study of Rasagiline Carbamates
AUTHORS: Nerea Alonso; Olga Caamano; Francisco J Romero Duran; Feng Luan; Natalia N D S Cordeiro ; Matilde Yanez; Humberto Gonzalez Diaz; Xerardo Garcia Mera;
PUBLISHED: 2013, SOURCE: ACS CHEMICAL NEUROSCIENCE, VOLUME: 4, ISSUE: 10, PAGES: 1393-1403
AUTHORS: Nerea Alonso; Olga Caamano; Francisco J Romero Duran; Feng Luan; Natalia N D S Cordeiro ; Matilde Yanez; Humberto Gonzalez Diaz; Xerardo Garcia Mera;
PUBLISHED: 2013, SOURCE: ACS CHEMICAL NEUROSCIENCE, VOLUME: 4, ISSUE: 10, PAGES: 1393-1403
368
TITLE: Multi-Target Inhibitors for Proteins Associated with Alzheimer: In Silico Discovery using Fragment-Based Descriptors
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Feng Luan; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: CURRENT ALZHEIMER RESEARCH, VOLUME: 10, ISSUE: 2, PAGES: 117-124
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Feng Luan; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: CURRENT ALZHEIMER RESEARCH, VOLUME: 10, ISSUE: 2, PAGES: 117-124
369
TITLE: New insights toward the discovery of antibacterial agents: Multi-tasking QSBER model for the simultaneous prediction of anti-tuberculosis activity and toxicological profiles of drugs Full Text
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: EUROPEAN JOURNAL OF PHARMACEUTICAL SCIENCES, VOLUME: 48, ISSUE: 4-5, PAGES: 812-818
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: EUROPEAN JOURNAL OF PHARMACEUTICAL SCIENCES, VOLUME: 48, ISSUE: 4-5, PAGES: 812-818
370
TITLE: Prediction of the baseline toxicity of non-polar narcotic chemical mixtures by QSAR approach Full Text
AUTHORS: Feng Luan; Xuan Xu; Huitao T Liu; Maria Natalia D S Dias Soeiro Cordeiro ;
PUBLISHED: 2013, SOURCE: CHEMOSPHERE, VOLUME: 90, ISSUE: 6, PAGES: 1980-1986
AUTHORS: Feng Luan; Xuan Xu; Huitao T Liu; Maria Natalia D S Dias Soeiro Cordeiro ;
PUBLISHED: 2013, SOURCE: CHEMOSPHERE, VOLUME: 90, ISSUE: 6, PAGES: 1980-1986
371
TITLE: QSAR Modeling for the Antimalarial Activity of 1,4-Naphthoquinonyl Derivatives as Potential Antimalarial Agents
AUTHORS: Feng Luan; Xuan Xu; Maria Natalia D S Dias Soeiro Cordeiro ; Huitao T Liu; Xiaoyun Y Zhang;
PUBLISHED: 2013, SOURCE: CURRENT COMPUTER-AIDED DRUG DESIGN, VOLUME: 9, ISSUE: 1, PAGES: 95-107
AUTHORS: Feng Luan; Xuan Xu; Maria Natalia D S Dias Soeiro Cordeiro ; Huitao T Liu; Xiaoyun Y Zhang;
PUBLISHED: 2013, SOURCE: CURRENT COMPUTER-AIDED DRUG DESIGN, VOLUME: 9, ISSUE: 1, PAGES: 95-107
INDEXED IN: 
Scopus 
WOS
Scopus WOS372
TITLE: Recent Advances on QSAR-Based Profiling of Agonist and Antagonist A(3) Adenosine Receptor Ligands
AUTHORS: Changliang L Deng; Feng Luan; Maykel Cruz Monteagudo ; Fernanda Borges ; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 9, PAGES: 1048-1068
AUTHORS: Changliang L Deng; Feng Luan; Maykel Cruz Monteagudo ; Fernanda Borges ; Natalia N D S Cordeiro ;
PUBLISHED: 2013, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 9, PAGES: 1048-1068
373
TITLE: Review of quantitative structure-activity/property relationship studies of dyes: recent advances and perspectives Full Text
AUTHORS: Feng Luan; Xuan Xu; Huitao T Liu; Maria Natalia D S Dias Soeiro Cordeiro ;
PUBLISHED: 2013, SOURCE: COLORATION TECHNOLOGY, VOLUME: 129, ISSUE: 3, PAGES: 173-186
AUTHORS: Feng Luan; Xuan Xu; Huitao T Liu; Maria Natalia D S Dias Soeiro Cordeiro ;
PUBLISHED: 2013, SOURCE: COLORATION TECHNOLOGY, VOLUME: 129, ISSUE: 3, PAGES: 173-186
374
TITLE: Review of Stochastic Stability and Analysis Tumor-Immune Systems
AUTHORS: Chis Oana; Opris Dumitru; Concu Riccardo ;
PUBLISHED: 2013, SOURCE: CURRENT BIOINFORMATICS, VOLUME: 8, ISSUE: 4, PAGES: 390-400
AUTHORS: Chis Oana; Opris Dumitru; Concu Riccardo ;
PUBLISHED: 2013, SOURCE: CURRENT BIOINFORMATICS, VOLUME: 8, ISSUE: 4, PAGES: 390-400
375
TITLE: Simultaneous Modeling of Antimycobacterial Activities and ADMET Profiles: A Chemoinformatic Approach to Medicinal Chemistry
AUTHORS: Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2013, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 14, PAGES: 1656-1665
AUTHORS: Alejandro Speck Planche; Cordeiro, MNDS ;
PUBLISHED: 2013, SOURCE: CURRENT TOPICS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 14, PAGES: 1656-1665
INDEXED IN: Scopus WOS
Scopus WOS376
TITLE: The role of 3D pharmacophore mapping based virtual screening for identification of novel anticancer agents: An overview
AUTHORS: Halder, AK ; Saha, A; Jha, T;
PUBLISHED: 2013, SOURCE: Current Topics in Medicinal Chemistry, VOLUME: 13, ISSUE: 9, PAGES: 1098-1126
AUTHORS: Halder, AK ; Saha, A; Jha, T;
PUBLISHED: 2013, SOURCE: Current Topics in Medicinal Chemistry, VOLUME: 13, ISSUE: 9, PAGES: 1098-1126
377
TITLE: Tin electrodeposition from choline chloride based solvent: Influence of the hydrogen bond donors Full Text
AUTHORS: Sonia Salome; Nuno M Pereira ; Elisabete S Ferreira ; Carlos M Pereira ; Silva, AF ;
PUBLISHED: 2013, SOURCE: JOURNAL OF ELECTROANALYTICAL CHEMISTRY, VOLUME: 703, PAGES: 80-87
AUTHORS: Sonia Salome; Nuno M Pereira ; Elisabete S Ferreira ; Carlos M Pereira ; Silva, AF ;
PUBLISHED: 2013, SOURCE: JOURNAL OF ELECTROANALYTICAL CHEMISTRY, VOLUME: 703, PAGES: 80-87
378
TITLE: TOPS-MODE model of multiplexing neuroprotective effects of drugs and experimental-theoretic study of new 1,3-rasagiline derivatives potentially useful in neurodegenerative diseases Full Text
AUTHORS: Feng Luan; Natalia N D S Cordeiro ; Nerea Alonso; Xerardo Garcia Mera; Olga Caamano; Francisco J Romero Duran; Matilde Yanez; Humberto Gonzalez Diaz;
PUBLISHED: 2013, SOURCE: BIOORGANIC & MEDICINAL CHEMISTRY, VOLUME: 21, ISSUE: 7, PAGES: 1870-1879
AUTHORS: Feng Luan; Natalia N D S Cordeiro ; Nerea Alonso; Xerardo Garcia Mera; Olga Caamano; Francisco J Romero Duran; Matilde Yanez; Humberto Gonzalez Diaz;
PUBLISHED: 2013, SOURCE: BIOORGANIC & MEDICINAL CHEMISTRY, VOLUME: 21, ISSUE: 7, PAGES: 1870-1879
379
TITLE: Unified Multi-target Approach for the Rational in silico Design of Anti-bladder Cancer Agents
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Feng Luan; Cordeiro, MNDS ;
PUBLISHED: 2013, SOURCE: ANTI-CANCER AGENTS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 5, PAGES: 791-800
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Feng Luan; Cordeiro, MNDS ;
PUBLISHED: 2013, SOURCE: ANTI-CANCER AGENTS IN MEDICINAL CHEMISTRY, VOLUME: 13, ISSUE: 5, PAGES: 791-800
380
TITLE: A ligand-based approach for the in silico discovery of multi-target inhibitors for proteins associated with HIV infection Full Text
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Feng Luan; Natalia N D S Cordeiro ;
PUBLISHED: 2012, SOURCE: MOLECULAR BIOSYSTEMS, VOLUME: 8, ISSUE: 8, PAGES: 2188-2196
AUTHORS: Alejandro Speck Planche; Valeria V Kleandrova; Feng Luan; Natalia N D S Cordeiro ;
PUBLISHED: 2012, SOURCE: MOLECULAR BIOSYSTEMS, VOLUME: 8, ISSUE: 8, PAGES: 2188-2196
