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7 results for “Dereplication”
An assessment of acd_lotus for the structural dereplication of natural products using 13C NMR spectroscopy data.
<p> A method that relies on carbon-13 nuclear magnetic resonance (NMR) spectroscopy, elaborated in earlier works of the author's research group, requires the availability of a dedicated database that establishes relationships between chemical structures, biological and chemical taxonomy, and spectroscopy. The construction of such a database, called <a href="https://doi.org/10.5281/zenodo.6621129">acd_lotus</a>, was reported earlier and its usefulness was only illustrated by <a href="https://doi.org/10.1002/cmtd.202200054">three examples</a>. This dataset provides the results of structure searches carried out starting from 58 carbon-13 NMR data sets recorded on compounds selected in the metabolomics section of BMRB, the biological magnetic resonance bank.</p> <p>Correction in the JSON file of ascochitine.</p> <p>Addition of a CSV file according to <a href="https://doi.org/10.1186/s13321-021-00520-4">Schymanski and Bolton</a> for the description of the selected compounds.</p> <p>Better PNG drawings for compounds 28, 38, 46, and 57.</p> <p>Better PNG drawing for compounds 7 and 26.</p>
16S V4-V5 metabarcoding reference databases and weighted naive-bayes classifiers, dereplicated
<p>16S metabarcoding databases and naive-bayes classifiers specific to the V4-V5 region. Built from the <a href="https://www.arb-silva.de/documentation/release-138/">Silva 138.1 SSU Ref NR 99</a> database using Qiime2 (version 2023.2) and the <a href="https://github.com/BenKaehler/q2-clawback">q2-clawback plugin.</a> Includes weighted classifiers for two Earth Microbiome Project Ontology (EMPO) 3 habitat types: "sediment (saline)" and "water (saline)" , with data downloaded from <a href="https://qiita.ucsd.edu/">Qiita</a>. Sequences were dereplicated with Rescript --p-mode 'uniq' , retaining identical sequence records that have differing taxonomies.</p> <p>Primers used:</p> <p>EMP 16S 515f: GTGYCAGCMGCCGCGGTAA</p> <p>EMP 16S 926r: CCGYCAATTYMTTTRAGTTT</p> <p><strong>Stats</strong></p> <p>286,948 unique sequences</p> <p>309,567 total sequences</p> <p>46,254 unique taxa (Level 7)</p> <table> <caption>File description</caption> <thead> <tr> <th scope="col"> <table> <thead> <tr> <th>File</th> <th>Description</th> </tr> </thead> <tbody> <tr> <td>make new 16S silva V4-V5 database.md</td> <td>Markdown with code used to generate databases</td> </tr> <tr> <td>silva-138-99-seqs.qza</td> <td>Full length Silva 138.1 SSU 99 sequences</td> </tr> <tr> <td>silva-138-99-tax.qza</td> <td>Taxa for full length Silva 138.1 SSU 99 database</td> </tr> <tr> <td>silva-138_1-99-515f_926r-uniq-seqs.qza</td> <td>Sequences for 16S V4-V5 (primers 515f, 926r), extracted from Silva 138.1 SSU 99, generated by qiime2-2023.2 (forward compatible), dereplicated</td> </tr> <tr> <td>silva-138_1-99-515f_926r-uniq-taxa.qza</td> <td>Taxa for silva-138_1-99-515f_926r-seqs.qza database, dereplicated</td> </tr> <tr> <td>uniform-silva-138_1-99-515f_926r-uniq-classifier.qza</td> <td>Unweighted (uniform) naive-bayes classifier for 16S V4-V5 (primers 515f, 926r) extracted from Silva 138.1 SSU 99, generated by qiime2-2023.2 (forward compatible)</td> </tr> <tr> <td>silva-138_1-99-515f_926r-uniq-sediment-saline-classifier.qza</td> <td>Weighted naive-bayes classifier for 16S V4-V5 (primers 515f, 926r) extracted from Silva 138.1 SSU 99, weighted for sediment-saline, generated by qiime2-2023.2 (forward compatible)</td> </tr> <tr> <td>silva-138_1-99-515f_926r-q2_2023_2-uniq-sediment-saline-weights.qza</td> <td>Weights used to generate silva-138_1-99-515f_926r-q2_2023_2-sediment-saline-classifier.qza</td> </tr> <tr> <td>silva-138_1-99-515f_926r-uniq-water-saline-classifier.qza</td> <td>Weighted naive-bayes classifier for 16S V4-V5 (primers 515f, 926r) extracted from Silva 138.1 SSU 99, weighted for water-saline, generated by qiime2-2023.2 (forward compatible)</td> </tr> <tr> <td>silva-138_1-99-515f_926r-uniq-water-saline-weights.qza</td> <td>Weights used to generate silva-138_1-99-515f_926r-water-saline-classifier.qza</td> </tr> </tbody> </table> </th> <th scope="col"> </th> </tr> </thead> <tbody> </tbody> </table> <p> </p>
Metagenome-Assembled Genome DRAM Annotations (EMERGE 97% dereplicated MAGs)
<p>This is the combined DRAM annotation outputs for the 1,864 97% dereplicated metagenome-assembled genomes from Stordalen Mire, Sweden. </p> <ul> <li>1864_97percentmags_annotations_combined.tsv.gz</li> <li>1864_97percentmags_metabolism_summary.xlsx</li> <li>product_0.html</li> <li>product_1.html</li> </ul> <p>METHODS:</p> <p>MAGs were annotated and distilled using DRAM (v1.4.0).</p> <p>FUNDING:<br> This research is a contribution of the EMERGE Biology Integration Institute ((https://emerge-bii.github.io/), funded by the National Science Foundation, Biology Integration Institutes Program, Award # 2022070.<br> We thank the Swedish Polar Research Secretariat and SITES for the support of the work done at the Abisko Scientific Research Station. SITES is supported by the Swedish Research Council's grant 4.3-2021-00164.<br> This study was also funded by the Genomic Science Program of the United States Department of Energy Office of Biological and Environmental Research, grant #s DE-SC0004632. DE-SC0010580. and DE-SC0016440.<br> A portion of this research was performed under the Facilities Integrating Collaborations for User Science (FICUS) program (proposal: 10.46936/fics.proj.2017.49950/60006215 and 10.46936/10.25585/60001148) and used resources at the DOE Joint Genome Institute (<a href="https://www.google.com/url?q=https://ror.org/04xm1d337&sa=D&source=docs&ust=1674859614742521&usg=AOvVaw2XgXYw9eI4JIXRMKn3S9Se">https://ror.org/04xm1d337</a>) and the Environmental Molecular Sciences Laboratory (<a href="https://www.google.com/url?q=https://ror.org/04rc0xn13&sa=D&source=docs&ust=1674859614742655&usg=AOvVaw3UXdoHIFmVjc-mXUhDXYQt">https://ror.org/04rc0xn13</a>), which are DOE Office of Science User Facilities operated under Contract Nos. DE-AC02-05CH11231 (JGI) and DE-AC05-76RL01830 (EMSL).</p>
Dereplicated Metagenome assembled genomes (MAGs) from Columbia River hyporheic sediments
<p>Fasta file containing 55 metagenome assembled genomes (MAGs) from publication to be submitted titled "<strong>Microbial genome-resolved metaproteomic analyses frame intertwined carbon and nitrogen cycles in river hyporheic sediments". </strong></p>
Dereplicated vOTUs recovered from a viromics extraction buffer chemistry experiment
<p>Database of de-replicated viral operational taxonomic units recovered from a viromics (viral-size fraction metagenomics) buffer chemistry experiment. </p>
Bioprospecting of soil-borne microorganisms and chemical dereplication of their anti-microbial constituents with the aid of UPLC-QTOF-MS and Molecular Networking approach
Open the record for dataset details and reuse information.
Databases of dereplicated vOTUs and MAGs recovered from a rewetting experiment on grassland soils
<p>Databases of dereplicated viral operational taxonomic units (vOTUs) and metagenome-assembled genomes (MAGs) recovered from a rewetting experiment on grassland soils.</p>
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Allen Brain Atlas
Allen Brain Atlas is an Allen Institute collection of brain map atlases, datasets, APIs, and analysis tools covering mouse, human, and non-human primate brain resources.
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DANDI Archive for NWB datasets
DANDI is a BRAIN Initiative archive for publishing and sharing neurophysiology data, including electrophysiology, optophysiology, and behavioral data packaged as NWB and related standards.
International Brain Laboratory public data
The International Brain Laboratory public data releases expose standardized mouse decision-making experiments, including Neuropixels recordings, widefield calcium imaging, behavior, and session metadata accessed through the ONE API.
OpenNeuro
OpenNeuro is a free, open platform for sharing neuroimaging datasets, with public search, dataset pages, and download paths for web, S3, DataLad, and the OpenNeuro CLI.