Difference between revisions of "Template:Article of the week"

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<div style="float: left; margin: 0.5em 0.9em 0.4em 0em;">[[File:Fig4 Scotti Molecules2018 23-1.png|240px]]</div>
<div style="float: left; margin: 0.5em 0.9em 0.4em 0em;">[[File:Fig1 Bispo-Silva Geosciences23 13-11.png|240px]]</div>
'''"[[Journal:SistematX, an online web-based cheminformatics tool for data management of secondary metabolites|SistematX, an online web-based cheminformatics tool for data management of secondary metabolites]]"'''
'''"[[Journal:Geochemical biodegraded oil classification using a machine learning approach|Geochemical biodegraded oil classification using a machine learning approach]]"'''


The traditional work of a natural products researcher consists in large part of time-consuming experimental work, collecting biota to prepare, extracts to analyze, and innovative metabolites to identify. However, along this long scientific path, much information is lost or restricted to a specific niche. The large amounts of data already produced and the science of metabolomics reveal new questions: Are these compounds known or new? How fast can this information be obtained? To answer these and other relevant questions, an appropriate procedure to correctly store [[information]] on the data retrieved from the discovered metabolites is necessary. The SistematX (http://sistematx.ufpb.br) interface is implemented considering the following aspects: (a) the ability to search by structure, [[SMILES (language)|SMILES]] (Simplified Molecular-Input Line-Entry System) code, compound name, and species; (b) the ability to save chemical structures found by searching; (c) the ability to display compound data results, including important characteristics for natural products chemistry; and (d) the user's ability to find specific information for taxonomic rank (from family to species) of the plant from which the compound was isolated, the searched-for molecule, and the bibliographic reference and Global Positioning System (GPS) coordinates. ('''[[Journal:SistematX, an online web-based cheminformatics tool for data management of secondary metabolites|Full article...]]''')<br />
[[Chromatography|Chromatographic]] oil analysis is an important step for the identification of biodegraded petroleum via peak visualization and interpretation of phenomena that explain the oil geochemistry. However, analyses of chromatogram components by geochemists are comparative, visual, and consequently slow. This article aims to improve the chromatogram analysis process performed during geochemical interpretation by proposing the use of [[convolutional neural network]]s (CNN), which are deep learning techniques widely used by big tech companies. Two hundred and twenty-one (221) chromatographic oil images from different worldwide basins (Brazil, USA, Portugal, Angola, and Venezuela) were used. The [[open-source software]] Orange Data Mining was used to process images by CNN. The CNN algorithm extracts, pixel by pixel, recurring features from the images through convolutional operations ... ('''[[Journal:Geochemical biodegraded oil classification using a machine learning approach|Full article...]]''')<br />
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Latest revision as of 13:37, 13 May 2024

Fig1 Bispo-Silva Geosciences23 13-11.png

"Geochemical biodegraded oil classification using a machine learning approach"

Chromatographic oil analysis is an important step for the identification of biodegraded petroleum via peak visualization and interpretation of phenomena that explain the oil geochemistry. However, analyses of chromatogram components by geochemists are comparative, visual, and consequently slow. This article aims to improve the chromatogram analysis process performed during geochemical interpretation by proposing the use of convolutional neural networks (CNN), which are deep learning techniques widely used by big tech companies. Two hundred and twenty-one (221) chromatographic oil images from different worldwide basins (Brazil, USA, Portugal, Angola, and Venezuela) were used. The open-source software Orange Data Mining was used to process images by CNN. The CNN algorithm extracts, pixel by pixel, recurring features from the images through convolutional operations ... (Full article...)
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