cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.6084/m9.figshare.14278794.v1
title: MUNDAU-MANGUABA LAGOON ESTUARY COMPLEX: CHARACTERIZATION OF NATURAL ORGANIC MATTER AND INTERACTION WITH Hg2+

description: The Mundaú-Manguaba lagoon estuary complex is the most important ecosystem in the state of Alagoas, and a source of sustenance for a large number of the state’s inhabitants. However, degradation by anthropic sources has been causing impacts on this ecosystem. Understanding the characteristics of the natural organic material of the waters of the mundaú-manguaba lagoon complex is extremely important to understand the interaction dynamics of the contaminants in these lagoons. Thus, the objective of this work was to extract and characterize aquatic humic substances from the Mundau-Manguaba lagoon complex and to evaluate the interaction of this organic material with mercury ions. The profile of the aquatic humic substances of the respective lagoons evidenced the greater influence of aliphatic groups in their structures. The interactions of aquatic humic substances and mercury ions are directly related to the oxygen groups in their structures, corroborated by Principal Component Analysis. Thus, understanding the water and organic matter characteristics present in the Mundaú-Manguaba estuarine lagoon complex is fundamental for establishing strategies, seeking the preservation of this ecosystem and remediation of environmental contamination.
DOI: 10.6084/m9.figshare.14278796
title: CHEMICAL CONSTITUENTS OF Sinningia mauroana AND SCREENING OF ITS EXTRACTS FOR ANTIMICROBIAL, ANTIOXIDANT AND CYTOTOXIC ACTIVITIES

description: Phytochemical study of aerial parts from Sinningia mauroana Chautems (Gesneriaceae) yielded 17 known compounds: sitosterol, stigmasterol, betulinic acid, oleanolic acid, hederagenin, maslinic acid, ursolic acid, pomolic acid, soranjidiol, methyl 4-hydroxyphenylacetate, 6-hydroxy-7-methoxy-α-dunnione, 7-hydroxy-6-methoxy-α-dunnione, jacaranone, calceolarioside A, conandroside, luteolin, and luteolin-7-O-glucoside. Complete NMR data of 6-hydroxy-7-methoxy-α-dunnione and 7-hydroxy-6-methoxy-α-dunnione were obtained in two different solvents. Hexane, ethyl acetate and ethanol extracts were screened for antimicrobial, antioxidant and cytotoxic activities. The antimicrobial activity was assayed against Staphylococcus aureus, S. epidermidis, Escherichia coli, Pseudomonas aeruginosa, Candida albicans, C. parapsilosis, C. dubliniensis, and C. glabrata, using the microdillution method. All extracts were inactive (MIC &gt; 100 µg mL-1). The antioxidant activity was evaluated with the ORAC method; the ethyl acetate and ethanol extracts were active (TE relative &gt; 800 µg g-1). The cytotoxic activity was tested against PC-3 (prostate) and SKMEL-103 (melanoma) human tumor cell lines, and 3T3 fibroblast cell line, using the MTT assay. The hexane extract showed strong activity against PC-3 and SKMEL-103 human tumor cell lines (IC50 &lt; 0.25 and 3.07 µg mL-1, respectively), and a lower activity towards 3T3 fibroblasts (IC50 = 6.84 µg mL-1). The other extracts were inactive (IC50 &gt; 50 µg mL-1).
DOI: 10.6084/m9.figshare.11997132.v1
title: METABOLIC PROFILE OF THE POLAR EXTRACTS OF THE LEAVES, BRANCHES AND BARKS OF Copaifera multijuga HAYNE (COPAÍBA mari-mari AMAZÔNIA) BY ESI-MS

description: Copaifera multijuga Hayne is the main species of the genus in the Amazon region, being exploited for copaiba oil production mainly because of its therapeutic properties. The plant parts (leaves, branches, and barks) are widely used in folk medicine. However, they are little explored in terms of chemical composition. In this study, the polar extracts of leaves, branches, and barks of the species were analysed by direct infusion in ESI-MS with the aid of reference standards and MS2 fragmentation experiments. Twenty-six substances (carboxylic acids, flavonoids, condensed tannins, a diterpene and fifteen isomers of galoylquinic acids) were detected. Metabolic profiles were similar between extracts of leaves and branches, especially with the detection of galloylquinic acids and carboxylic acids. In bark extract, condensed tannins epicatechin-(4β-8)-epiafzelechin (dimer) and epicatechin-(4β-8)-epiafzelechin-(4β-8)-epiafzelechin (trimer) were detected. The PCA showed differences and similarities in the chemical composition of the copaíba mari-mari extracts. Thus, galloylquinic acids and flavonoids kaempferol, 7-O-methyl-kaempferol, quercetin-3-O-L-pentoside, and quercetin-3-O-L-rhamnoside are described for the first time in C. multijuga. The phytotherapeutic properties of teas of the plant parts of the species may be associated with the suggested polyphenols.
DOI: 10.6084/m9.figshare.14278796.v1
title: CHEMICAL CONSTITUENTS OF Sinningia mauroana AND SCREENING OF ITS EXTRACTS FOR ANTIMICROBIAL, ANTIOXIDANT AND CYTOTOXIC ACTIVITIES

description: Phytochemical study of aerial parts from Sinningia mauroana Chautems (Gesneriaceae) yielded 17 known compounds: sitosterol, stigmasterol, betulinic acid, oleanolic acid, hederagenin, maslinic acid, ursolic acid, pomolic acid, soranjidiol, methyl 4-hydroxyphenylacetate, 6-hydroxy-7-methoxy-α-dunnione, 7-hydroxy-6-methoxy-α-dunnione, jacaranone, calceolarioside A, conandroside, luteolin, and luteolin-7-O-glucoside. Complete NMR data of 6-hydroxy-7-methoxy-α-dunnione and 7-hydroxy-6-methoxy-α-dunnione were obtained in two different solvents. Hexane, ethyl acetate and ethanol extracts were screened for antimicrobial, antioxidant and cytotoxic activities. The antimicrobial activity was assayed against Staphylococcus aureus, S. epidermidis, Escherichia coli, Pseudomonas aeruginosa, Candida albicans, C. parapsilosis, C. dubliniensis, and C. glabrata, using the microdillution method. All extracts were inactive (MIC &gt; 100 µg mL-1). The antioxidant activity was evaluated with the ORAC method; the ethyl acetate and ethanol extracts were active (TE relative &gt; 800 µg g-1). The cytotoxic activity was tested against PC-3 (prostate) and SKMEL-103 (melanoma) human tumor cell lines, and 3T3 fibroblast cell line, using the MTT assay. The hexane extract showed strong activity against PC-3 and SKMEL-103 human tumor cell lines (IC50 &lt; 0.25 and 3.07 µg mL-1, respectively), and a lower activity towards 3T3 fibroblasts (IC50 = 6.84 µg mL-1). The other extracts were inactive (IC50 &gt; 50 µg mL-1).
DOI: 10.6084/m9.figshare.14278798
title: ANALYSIS OF FUELS BY PHOTOMETRY, PORTABLE NIRS AND 1H NMR - A COMPARISON WITH STANDARD TECHNIQUES

description: It has been recurring adulterations in fuels (such as gasoline, ethanol and diesel), being necessary the exploration of the use of more modern analytical techniques capable of controlling the quality of these fuels, since some regulated tests may be inefficient to detect the adulteration. Among them, it is highlighted proton nuclear magnetic resonance (1H NMR) spectroscopy, and portable near infrared spectroscopy (microNIR). In this work, it was studied the conformities of 115 samples of seized fuels (76 of gasoline, 23 of ethanol, and 16 of diesel) by means of standardized techniques with parameters established by the ANP. Results obtained were compared to photometer, MicroNIR and 1H NMR analyzes. The analyzes carried out by ANP showed four nonconforming samples (one of gasoline and three of ethanol). By the photometric technique, only 14 gasoline samples had ethanol content permitted by legislation (i.e ≈ 27 %v/v). By 1H NMR analysis, it was possible to verify nonconformities by presence of aromatics and olefins compounds in the gasoline and diesel samples as well as of methanol in fuel ethanol samples. It is also worth noting the efficiency of MicroNIR when combined with unsupervised chemometric methods to indicate nonconformities presented by 1H NMR and photometry techniques.
DOI: 10.6084/m9.figshare.14278801
title: EVALUATION OF AMAZONIAN FUNGI BIOMASS AS A SOURCE OF LIPASES FOR BIOCATALYSIS

description: We evaluated the biomass of twenty Amazonian fungal isolates as a potential source of mycelium-bound lipases with hydrolytic, synthetic or enantioselective activity for biocatalysis application. We compared the hydrolytic activity of three biomass treatments (delipidated, non-delipidated and cultivated in medium without inducer). Delipidated biomass showed better results in the hydrolysis of p-nitrophenyl palmitate compared to the other two treatments for fifteen isolates. Delipidated biomass of six Aspergillus strains and UEA_115 strain showed a high synthesis activity of ethyl palmitate by transesterification in organic medium. Results were confirmed by spectrophotometry (410 nm) and gas chromatography. In this reaction, the isolate DPUA_1539 A. flavo-furcatis reached a maximum value of 668.5 ± 23.5 mU g-1. Enantioselective activity assays indicated that biomass-bound lipases from UEA_115 isolate (E = 3.58; ees = 7 ± 0) and in particular from the DPUA_1539 A. flavo-furcatis isolate (E = 24.15; ees = 91 ± 1) have the ability to discriminate enantiomers of the drug ibuprofen by ester synthesis, preferably with (R)-enantiomer. These results encourage further investigations of these fungi as potential lipase suppliers for biocatalytic processes such as biodiesel production and enantiopure drugs.
DOI: 10.6084/m9.figshare.14278803.v1
title: Influence of frequency and participation on performance in a student-centered learning environment

description: The aim of this research was to verify student performance, participation and frequency when they study in a student-centered learning environment. Data collection included the application of questionnaires and semi-structured interviews. Data analysis combined quantitative and qualitative approaches. In the results on frequency and participation, 32% of the students had a high number of absences and more than 25% indicated participation less than or equal to 5 (in a 1-10 scale). This is an expressive data, since the low engagement, due to absence in classes, or low participation, in a course aligned with Vygotsky’s assumptions, compromises the construction of knowledge. In these environments, it is not enough that the students try to solve the proposed questions by themselves: the adopted strategy presupposes the social interaction as a differential for learning promotion. Regarding performance, 37% of them were disapproved. To understand the reasons of such unsatisfactory performance, semi-structured interviews were conducted. The analysis of these data revealed that the overload of credits had a great impact on participation and frequency in biochemistry classes. This data indicates the need for integrated curricular organization, without which, even innovative disciplines, with student-centered methods, have discrete possibilities of success.
DOI: 10.17608/k6.auckland.14274794
title: Supplementary data 6. The 14 significant modules detected from the Ai-PPIN

description: We identified 14 significant network modules from the Ai-PPIN using Louvain community detection algorithm. The list of proteins representing each module and the edgelist corresponding to each module is presented here.
DOI: 10.6084/m9.figshare.14278798.v1
title: ANALYSIS OF FUELS BY PHOTOMETRY, PORTABLE NIRS AND 1H NMR - A COMPARISON WITH STANDARD TECHNIQUES

description: It has been recurring adulterations in fuels (such as gasoline, ethanol and diesel), being necessary the exploration of the use of more modern analytical techniques capable of controlling the quality of these fuels, since some regulated tests may be inefficient to detect the adulteration. Among them, it is highlighted proton nuclear magnetic resonance (1H NMR) spectroscopy, and portable near infrared spectroscopy (microNIR). In this work, it was studied the conformities of 115 samples of seized fuels (76 of gasoline, 23 of ethanol, and 16 of diesel) by means of standardized techniques with parameters established by the ANP. Results obtained were compared to photometer, MicroNIR and 1H NMR analyzes. The analyzes carried out by ANP showed four nonconforming samples (one of gasoline and three of ethanol). By the photometric technique, only 14 gasoline samples had ethanol content permitted by legislation (i.e ≈ 27 %v/v). By 1H NMR analysis, it was possible to verify nonconformities by presence of aromatics and olefins compounds in the gasoline and diesel samples as well as of methanol in fuel ethanol samples. It is also worth noting the efficiency of MicroNIR when combined with unsupervised chemometric methods to indicate nonconformities presented by 1H NMR and photometry techniques.
DOI: 10.6084/m9.figshare.14278801.v1
title: EVALUATION OF AMAZONIAN FUNGI BIOMASS AS A SOURCE OF LIPASES FOR BIOCATALYSIS

description: We evaluated the biomass of twenty Amazonian fungal isolates as a potential source of mycelium-bound lipases with hydrolytic, synthetic or enantioselective activity for biocatalysis application. We compared the hydrolytic activity of three biomass treatments (delipidated, non-delipidated and cultivated in medium without inducer). Delipidated biomass showed better results in the hydrolysis of p-nitrophenyl palmitate compared to the other two treatments for fifteen isolates. Delipidated biomass of six Aspergillus strains and UEA_115 strain showed a high synthesis activity of ethyl palmitate by transesterification in organic medium. Results were confirmed by spectrophotometry (410 nm) and gas chromatography. In this reaction, the isolate DPUA_1539 A. flavo-furcatis reached a maximum value of 668.5 ± 23.5 mU g-1. Enantioselective activity assays indicated that biomass-bound lipases from UEA_115 isolate (E = 3.58; ees = 7 ± 0) and in particular from the DPUA_1539 A. flavo-furcatis isolate (E = 24.15; ees = 91 ± 1) have the ability to discriminate enantiomers of the drug ibuprofen by ester synthesis, preferably with (R)-enantiomer. These results encourage further investigations of these fungi as potential lipase suppliers for biocatalytic processes such as biodiesel production and enantiopure drugs.
DOI: 10.6084/m9.figshare.14278803
title: Influence of frequency and participation on performance in a student-centered learning environment

description: The aim of this research was to verify student performance, participation and frequency when they study in a student-centered learning environment. Data collection included the application of questionnaires and semi-structured interviews. Data analysis combined quantitative and qualitative approaches. In the results on frequency and participation, 32% of the students had a high number of absences and more than 25% indicated participation less than or equal to 5 (in a 1-10 scale). This is an expressive data, since the low engagement, due to absence in classes, or low participation, in a course aligned with Vygotsky’s assumptions, compromises the construction of knowledge. In these environments, it is not enough that the students try to solve the proposed questions by themselves: the adopted strategy presupposes the social interaction as a differential for learning promotion. Regarding performance, 37% of them were disapproved. To understand the reasons of such unsatisfactory performance, semi-structured interviews were conducted. The analysis of these data revealed that the overload of credits had a great impact on participation and frequency in biochemistry classes. This data indicates the need for integrated curricular organization, without which, even innovative disciplines, with student-centered methods, have discrete possibilities of success.
DOI: 10.6084/m9.figshare.14278805
title: REUSE OF COLLAGEN AND HYDROXYAPATITE FROM THE WASTE PROCESSING OF FISH TO PRODUCE POLYETHYLENE COMPOSITES

description: In recent years, the increase in the generation of waste (e.g., bones and skin) from the processing of fish-based food related to the increase in fish consumption and the accumulation of synthetic polymers in the environment are causing major environmental concerns. Hydroxyapatite (HA) extracted from the bones and collagen from the skin of fish processing residues can be combined with synthetic polymers to maximize the use of waste material derived from fish while simultaneously reducing the use of synthetic polymers. Hence, in this study, collagen and HA were extracted from the carcasses of Lophiosilurus alexandri, and the obtained materials were reused to prepare low-density polyethylene (LDPE) blends and composites. The integrity of the triple helix structure of collagen was confirmed by FTIR and DSC showing that there was no collagen denaturation during its extraction and sample processing. The results indicated that the material produced by the incorporation of collagen into LDPE compatibilized with polyethylene-graft-maleic anhydride exhibits good mechanical and surface properties for use as a support material for ornamental articles, among other applications.
DOI: 10.6084/m9.figshare.14278805.v1
title: REUSE OF COLLAGEN AND HYDROXYAPATITE FROM THE WASTE PROCESSING OF FISH TO PRODUCE POLYETHYLENE COMPOSITES

description: In recent years, the increase in the generation of waste (e.g., bones and skin) from the processing of fish-based food related to the increase in fish consumption and the accumulation of synthetic polymers in the environment are causing major environmental concerns. Hydroxyapatite (HA) extracted from the bones and collagen from the skin of fish processing residues can be combined with synthetic polymers to maximize the use of waste material derived from fish while simultaneously reducing the use of synthetic polymers. Hence, in this study, collagen and HA were extracted from the carcasses of Lophiosilurus alexandri, and the obtained materials were reused to prepare low-density polyethylene (LDPE) blends and composites. The integrity of the triple helix structure of collagen was confirmed by FTIR and DSC showing that there was no collagen denaturation during its extraction and sample processing. The results indicated that the material produced by the incorporation of collagen into LDPE compatibilized with polyethylene-graft-maleic anhydride exhibits good mechanical and surface properties for use as a support material for ornamental articles, among other applications.
DOI: 10.6084/m9.figshare.14278808
title: OPENING THE PANDORA’S BOX OF NANOMEDICINE: THERE IS INDEED‘PLENTY OF ROOM AT THE BOTTOM’

description: Limitations of conventional treatment and dosage forms prompted the investigation of novel approaches that combine efficacy, selectivity and fewer adverse effects. These are the main promises of nanomedicine, generally defined as the application of nanotechnology to the biomedical field. Despite the considerable advances over the years and the large number of publications resulting from the growth of nanomedicine, there are still many hurdles and unknown factors limiting its successful translation from promise to reality. These factors range from the lack of standardization in the terminology and regulations, to the lack of understanding of interactions between nanocarriers and the biological system, and their influence on drug pharmacodynamics. In this manuscript, we aim at presenting and discussing concepts and terminologies used in the nanomedicine field and examining the main types of nanocarriers and their effects to modulate biological barriers and aid drug transport, bioavailability and targeting.
DOI: 10.6084/m9.figshare.14278808.v1
title: OPENING THE PANDORA’S BOX OF NANOMEDICINE: THERE IS INDEED‘PLENTY OF ROOM AT THE BOTTOM’

description: Limitations of conventional treatment and dosage forms prompted the investigation of novel approaches that combine efficacy, selectivity and fewer adverse effects. These are the main promises of nanomedicine, generally defined as the application of nanotechnology to the biomedical field. Despite the considerable advances over the years and the large number of publications resulting from the growth of nanomedicine, there are still many hurdles and unknown factors limiting its successful translation from promise to reality. These factors range from the lack of standardization in the terminology and regulations, to the lack of understanding of interactions between nanocarriers and the biological system, and their influence on drug pharmacodynamics. In this manuscript, we aim at presenting and discussing concepts and terminologies used in the nanomedicine field and examining the main types of nanocarriers and their effects to modulate biological barriers and aid drug transport, bioavailability and targeting.
DOI: 10.6084/m9.figshare.14278811
title: CHEMICAL VARIABILITY OF Allamanda cathartica L. FLOWERS ASSESSED BY MULTIVARIATE DATA ANALYSIS

description: The aim of this study was to determine the chemical variability of Allamanda cathartica flowers collected in different localities of Santa Catarina State, Brazil. Extractive solutions (25 samples) were analyzed by HPLC-DAD for the qualitative and quantitative profiles of the iridoid plumieride, the flavonoid rutin as well as total flavonoid content expressed in rutin. The chemical variability was evaluated by Principal Component Analysis (PCA) and Hierarchical Clustering Analysis (HCA). The samples demonstrated similar chromatographic profiles. In PCA analysis, Araquari samples AC01, AC08 and AC25 did not group with other samples obtained from other locations. In the HCA analysis, it was possible to observe hierarchially similar groups, generating 5 clusters. Group 5 (samples AC01, AC08 and AC25) presented lower similarity compared to the other groups. This dissimilarity can be explained by the amount of metabolites from each collection. Regarding the content of markers, it was observed a variation between 27 to 230 mg/g, 2.7 to 9.5 mg/g and 7.14 to 17.8 mg/g for plumieride, rutin, and total flavonoids, respectively. The samples from Araquari (AC01, AC08, AC25) presented the highest concentrations of chemical markers. Therefore, for reproducibility and standardization of A. cathartica flower extracts, it is important to determine the location and the plant cultivation conditions.
DOI: 10.6084/m9.figshare.14278816
title: PARTICLE SIZE DISTRIBUTION APPLIED TO MILK POWDER REHYDRATION

description: Besides increasing shelf life of fluid milk, milk powder has physical and functional properties that allow it to be used as ingredient. The rehydration process is complex and happens in four steps: wettability, sinkability, dispersibility and solubility. Works have been conducted aiming at the development of an easier, more convenient and reproducible method to evaluate the dissolution properties of dairy powders. Therefore, the aim of this work was to evaluate dispersibility and solubility through particle size distribution in order to establish a new rehydration index for whole milk powder. The particle size distribution and morphological characteristics of seven samples of milk powder (from A to G) were analyzed. Samples F and C differed from the others which formed a similar group. Principal component analysis divided the samples into three different groups, allowing the indication of an efficient rehydration index to determine the powders dispersability.