cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17632/kxjmz6xgxy.1
title: Improving identification of determinants of evidence-based practice implementation - Validation Data Set

description: This dataset contains ratings of each intervention characteristic item from health professionals who were implementing or planning to implement a new practice. The survey was administered in June through August 2022. 207 people were eligible and started the survey but 175 were counted as completing the survey. Only quantitative variables are included (ratings of each intervention characteristics, use of the practice) and some participant characteristics.
DOI: 10.5517/ccdc.csd.cc2ddjt5
title: CCDC 2216587: Experimental Crystal Structure Determination

description: Related Article: Chong-Yang Shi, Qian Wang, Li-Gao Liu, Jing Wang, Rui Chen, Lin Liu, Long-Wu Ye, Xin Lu, Xin-Qi Zhu|2024|Org.Chem.Front.|11|7085|doi:10.1039/D4QO01623H
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.17632/7jc9brfw7c.1
title: Improving identification of determinants of evidence-based practice implementation: Content Validity Assessment

description: This dataset contains relevance ratings on a four-point scale from 30 implementation scientists and practitioners for items developed to measure perceptions of intervention characteristics. The survey was administered between August and October 2021. Only the quantitative data and some participant characteristics are included in the dataset. No qualitative data is included.
DOI: 10.17632/83r878gv3c.1
title: LDHU3_14.1130

description: Protein kinase; Leishmania donovani (HU3 strain)
DOI: 10.15468/dl.rsxdhm
title: Occurrence Download

description: A dataset containing 36102 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is one of (South Africa, Lesotho, Eswatini)",
 "TaxonKey is one of (Calidris pugnax (Linnaeus, 1758))",
 "BasisOfRecord is one of (Human Observation, Observation)",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Year is greater than or equal to 1950",
 "OccurrenceStatus is Present",
 "DistanceFromCentroidInMeters is greater than or equal to 2000"
 ]
}

 The dataset includes 36102 records from 11 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0004505-250117142028555/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.17632/zs9866w2pn.1
title: Discovery of Non-Peptide GLP-1R Natural Agonists for Enhancing Coronary Safety in Type 2 Diabetes Patients

description: smooth animation of normal mode vibration along the first eigenvector, for trajectories of compounds 12 and 40 in supporting information.
DOI: 10.17632/swbfnyd2kn.1
title: Selenite bioremediation by food-grade probiotic Lactobacillus casei ATCC 393: insights from proteomics analysis

description: Microorganisms capable of converting toxic selenite into elemental selenium (Se0) are considered as an important and effective approach for bioremediation of Se contamination. In this study, we investigated the mechanism of reducing selenite to Se0 and forming Se nanoparticles (SeNPs) by food-grade probiotic Lactobacillus casei ATCC 393 (L. casei ATCC 393) through proteomics analysis. Proteomics analysis revealed that selenite induced a significant increase in the expression of glutaredoxin, oxidoreductase, and ATP binding cassette (ABC) transporter, which has the ability to transport glutathione (GSH) and selenite. Selenite treatment significantly increased the CydC and CydD (putative cysteine and glutathione importer, ABC transporter) mRNA expression level, GSH content and GSH reductase activity. Furthermore, supplementation with an additional GSH significantly increased the reduction rate of selenite, while GSH depletion significantly inhibited the reduction of selenite, indicating that GSH-mediated Painter-type reaction may be the main pathway of selenite reduction in L. casei ATCC 393. Moreover, nitrate reductase also participates in the reduction process of selenite, but it is not the primary factor.
DOI: 10.5517/ccdc.csd.cc2k7h7k
title: CCDC 2360688: Experimental Crystal Structure Determination

description: Related Article: Gong-Xin Li, Yi-Ming Zhou, Zhen-Jiang Xu, Chi-Ming Che|2024|Org.Chem.Front.|11|7114|doi:10.1039/D4QO01529K
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2klm0t
title: CCDC 2371376: Experimental Crystal Structure Determination

description: Related Article: Honglei Li, Guodong Zhao, Qingxin Tang, Hongkun Tian, Lixiang Wang|2024|Org.Chem.Front.|11|7205|doi:10.1039/D4QO01305K
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2klm4y
title: CCDC 2371380: Experimental Crystal Structure Determination

description: Related Article: Honglei Li, Guodong Zhao, Qingxin Tang, Hongkun Tian, Lixiang Wang|2024|Org.Chem.Front.|11|7205|doi:10.1039/D4QO01305K
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.17632/r9v3dcb75r.1
title: FBXL19 promotes malignant behaviors via activation of MAPK signaling and negatively correlates with prognosis in liver cancer

description: Supplement 1 shows the data for the heatmap of Figure 6A; Supplement 2 shows the data for the GSEA enrichment map of Figure 6B.
DOI: 10.5517/ccdc.csd.cc2klrsq
title: CCDC 2371524: Experimental Crystal Structure Determination

description: Related Article: Honglei Li, Guodong Zhao, Qingxin Tang, Hongkun Tian, Lixiang Wang|2024|Org.Chem.Front.|11|7205|doi:10.1039/D4QO01305K
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2knsrs
title: CCDC 2373476: Experimental Crystal Structure Determination

description: Related Article: Yan He, Hua Sun, Guo-Hui Liu, Ying-Chun Wang, Ying-Ming Pan|2024|Org.Chem.Front.|11|7078|doi:10.1039/D4QO01519C
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.17632/232j5bc8vs.1
title: Circulation types for European regions (1948–2021)

description: Circulation types were calculated for five regions located across the central latitude strip of Europe (along the 50° latitude). The regions correspond to 5° × 5° longitude–latitude grid boxes stretching from Western to Eastern Europe, with centers at [5°E, 50°N], [10°E, 50°N], [15°E, 50°N], [20°E, 50°N], and [25°E, 50°N]. Circulation types (CTs) were derived from three circulation indices (flow strength, direction, and vorticity; Jenkinson & Collison, 1977). Circulation indices were calculated in a daily time step using the sea level pressure from the NCEP/NCAR reanalysis (Kalnay et al., 1996). Based on the Lamb (1972) catalogue, 27 CTs adjusted for each region were derived from the indices (Blenkinsop et al., 2009). A detailed description of the classification of daily patterns into CTs was published by Lhotka et al. (2020) for Central Europe, and the procedure was analogous for the other regions under study.

Blenkinsop, S., Jones, P. D., Dorling, S. R. & Osborn, T. J. (2009). Observed and modelled influence of atmospheric circulation on central England temperature extremes. International Journal of Climatology, 29(11), 1642–1660. https://doi.org/10.1002/joc.1807
Jenkinson, A.F. & Collison, B. P. (1977). An initial climatology of gales over the North Sea. Synoptic Climatology Branch Memorandum 62, Meteorological Office, London, UK. 18 pp.
Kalnay, E., Kanamitsu, M., Kistler, R., Collins, W., Deaven, D., Gandin, L., et al. (1996). The NCEP/NCAR 40-year reanalysis project. Bulletin of the American Meteorological Society, 77(3), 437–471. https://doi.org/10.1175/1520-0477(1996)077&lt;0437:TNYRP&gt;2.0.CO;2
Lamb, H. H. (1972). British Isles Weather Types and a Register of Daily Sequence of Circulation Patterns, 1861–1971. Geophysical Memoir, 116, HMSO, London (UK), 85 pp.
Lhotka, O., Trnka, M., Kysely, J., Markonis, Y., Balek, J. & Mozny, M. (2020). Atmospheric Circulation as a Factor Contributing to Increasing Drought Severity in Central Europe. Journal of Geophysical Research: Atmospheres, 125(18), e2019JD032269, 585–594. https://doi.org/10.1029/2019JD032269
DOI: 10.17632/sf9gvykfnc.1
title: A Learnable Dynamic Evolutionary Optimization Algorithm

description: Explanation for data folder: 
The output of the four algorithms
DOI: 10.5517/ccdc.csd.cc2kzjvy
title: CCDC 2382841: Experimental Crystal Structure Determination

description: Related Article: Gang-Ding Wang, Wen-Jie Shi, Yong-Zhi Li, Weigang Lu, Lei Hou, Dan Li|2025|J.Mater.Chem.A|13|1213|doi:10.1039/D4TA06472K
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2kzk9f
title: CCDC 2382855: Experimental Crystal Structure Determination

description: Related Article: Jodie L. Hann, Catherine L. Lyall, Gabriele Kociok-Köhn, Simon E. Lewis|2024|Org.Chem.Front.|11|7011|doi:10.1039/D4QO01793E
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2kzkbg
title: CCDC 2382856: Experimental Crystal Structure Determination

description: Related Article: Jodie L. Hann, Catherine L. Lyall, Gabriele Kociok-Köhn, Simon E. Lewis|2024|Org.Chem.Front.|11|7011|doi:10.1039/D4QO01793E
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.17632/ffbkzd6yb8.1
title: Are scandium sulfate complexes an effective means of scandium mobilization?

description: Data for the manuscript titled "Are scandium sulfate complexes an effective means of scandium mobilization?” by Zhang, Xue-Ni; Williams-Jones, Anthony.E.; Yuan, Shun-Da; Wang, Jiaxin (2024). Table 1 shows the conditions for the AIMD simulation of the geometry of Sc-sulfate complexes at 175 - 250 oC and vapor-saturated water pressure. Table 2 shows the conditions for and results of experiments investigating the speciation of Sc in sulfate-bearing aqueous solutions. Table 3 shows bond lengths and configurations predicted by AIMD simulations for Sc-SO4 complexes. Table 4 shows the formation constants (log β) at temperatures from 175 to 250 oC for the scandium species identified in this study. Table 5 shows the Ryzhenko–Bryzgalin (MRB) model parameters for Sc(SO4)2-. Table 6 shows the equilibrium constants (log k) and their associated uncertainty (2σ) for the Sc2O3 dissolution reaction. Table 7 show the published formation constants for Sc3+sulfate complexes at ambient temperature. Supplementary files show the X-Ray diffractogram (XRD) for Sc2O3 after completion of experiments.
DOI: 10.15468/dl.xfpspn
title: Occurrence Download

description: A dataset containing 1864 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Acanthus ilicifolius L."
 ]
}

 The dataset includes 1864 records from 98 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0004508-250117142028555/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.17632/7xw9p4syxr.1
title: Using respiratory gas flux and backward dietary energy partitioning to estimate energy intake by beef cattle when fed a high-concentrate diet

description: This dataset includes respiratory gas flux for cattle consuming titrated levels of gross energy at the USDA-ARS Oklahoma and Central Plains Agricultural Research Center, Southern Plains Experimental Range. A data dictionary is also included.
DOI: 10.17632/dz2k6rmsrb.2
title: Mechanisms of arsenic adsorption onto illite and elucidation of surface complexation model

description: This data describe the experimental and PHREEQC code for the adsorption of arsenic onto illite minerals. These observations included isotherm adsorption, kinetics, desorption, pH effect, ionic strength effect, and coexisting ion effect.
DOI: 10.17632/kjtdgk3f25.4
title: CDKN2A Deletion Remodels Lipid Metabolism to Prime Glioblastoma for Ferroptosis

description: Lipidomic abundance data (percent of total, percent of class) for 84 bulk patient tumors, 29 mouse xenografts, 43 gliomasphere cultures, and 27 biological replicates of genetically manipulated gliomasphere cultures. Further details on the data provided are described here https://youtu.be/PjUbVt968co

Data related to Figure 1C including lipid species - gene correlation values and clusters can be found in the "Correlation Analysis" folder.
DOI: 10.5517/ccdc.csd.cc2lmshj
title: CCDC 2402298: Experimental Crystal Structure Determination

description: Related Article: Dangyue Yin, Boqian Yang, Hongyu Lv, Siwei Song, Yi Wang, Qinghua Zhang|2025|CrystEngComm|27|8|doi:10.1039/D4CE01036A
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.17632/kjtdgk3f25.1
title: CDKN2A Deletion Remodels Lipid Metabolism to Prime Glioblastoma for Ferroptosis

description: Lipidomic abundance data (percent of total, percent of class) for 84 bulk patient tumors, 29 mouse xenografts, 43 gliomasphere cultures, and 27 biological replicates of genetically manipulated gliomasphere cultures. Further details on the data provided are described here https://youtu.be/PjUbVt968co
DOI: 10.5517/ccdc.csd.cc2lr3fx
title: CCDC 2405489: Experimental Crystal Structure Determination

description: Related Article: P. Koch, D. Schollmeyer|2024|IUCrData|9|x241152|doi:10.1107/S2414314624011520
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.17632/kjtdgk3f25.2
title: CDKN2A Deletion Remodels Lipid Metabolism to Prime Glioblastoma for Ferroptosis

description: Lipidomic abundance data (percent of total, percent of class) for 84 bulk patient tumors, 29 mouse xenografts, 43 gliomasphere cultures, and 27 biological replicates of genetically manipulated gliomasphere cultures. Further details on the data provided are described here https://youtu.be/PjUbVt968co
DOI: 10.17632/byjrp4xns7.1
title: Sterechinus neumayeri v1 genome annotation

description: Genome annotation was performed using the BRAKER3 pipeline (Gabriel et al., 2023). A repeat library was generated with RepeatModeler (Smit & Hubley, 2010). The repeat families were compared to known echinoderm protein coding gene models using BLAST and any repeat with a significant hit (e-value &lt; 5e-5) were removed. The resulting repeat library was used to identify and mask repeats using RepeatMasker prior to annotation (Smit et al., 2010). BRAKER was run using protein models from S. purpuratus (available on echinobase https://download.xenbase.org/echinobase/Genomics/Spur5.0/sp5_0_GCF.gff3.gz ; last accessed 2/15/24), L.variegatus (available from echinobase https://download.xenbase.org/echinobase/Genomics/Lvar3.0/Lvar3_0_GCF_proteins.fa.gz ; last accessed 2/15/24), and L.pictus (available from echinobase https://download.xenbase.org/echinobase/Genomics/Lpic2.1/Lpic2_1_GCF_proteins.fa.gz ; last accessed 2/15/24) along with publicly available transcriptomic data on NCBI sequencing read archive and in house RNAseq dataset spanning embryogenesis. The gene models were annotated using the notation SNE_XXXXXX and analyzed for ‘completeness’ with BUSCO version 4 using the metazoan gene set (Simão et al., 2015). GRN gene curation was first carried out by curating a list of gene regulatory network genes (supplemental file X). Then, orthofinder2 (Emms & Kelly, 2019) was used to identify orthologs between S.neumayeri, L.variegatus, S.purupratus, and recently published genome annotation for P.lividus (Emms & Kelly, 2019; Marlétaz et al., 2023).
DOI: 10.17028/rd.lboro.27959811
title: Supplementary information files for " Valorising wood ash as an effective green alternative pulping agent for achieving a high yield of banana micro-lignocellulose fibres of enhanced crystallinity"

description: Supplementary information files for article " Valorising wood ash as an effective green alternative pulping agent for achieving a high yield of banana micro-lignocellulose fibres of enhanced crystallinity"This study aims to explore the use of wood ash, a common waste, as an alternative and eco-friendly pulping agent. The first and most important singularity of the study is that wood ash solution, though mild in nature, has proven to be an effective pulping agent (in comparison with the common pulping solution, sodium hydroxide): comparable lignin (45%) and hemicellulose (50%) removal, high crystallinity (72–77%) and high pulp yield (70%) were obtained. Another particularity of this study is that the reported advanced aspects of pulped banana fibres, notably the chemical functionality, crystallinity and crystallite size have been correlated with the chemical composition of the wood ash used: calcium pectinate was formed on the pulped fibre surface. It apparently played a role in enhancing the fibre crystallinity. Moreover, another specialness of this study is that non-conventional factors, which would have significant bearing during industrial scale processing, such as liquor ratio, fibre input size and duration have been investigated—the latter has shown that to attain maximum delignification, small fibre input size at a high liquor ratio of 40 for an extended period of 2 h are necessary. Finally, the pulped banana fibres (which were intended to be used for membrane fabrication for use in water purification system) have depicted their applicability in the fabrication of ultrafiltration membranes by virtue of their aspect ratio, semi-hydrophilicity (due to presence of residual lignin) and projected high mechanical strength (due to high crystallinity and low crystallite size). Graphical Abstract: Graphical abstract showing outcomes when pulping with wood ash solution.© The Authors, CC BY4.0
DOI: 10.17632/45phyv2d2b.1
title: LINF_100016800

description: histone H3; Leishmania infantum (strain JPCM5)
DOI: 10.17632/4d92bgskr9.1
title: LINF_100015100

description: Adenosine/AMP deaminase; Leishmania infantum (strain JPCM5)
DOI: 10.17632/wjb58gzppn.1
title: Dataset on physical-chemical and marine water quality variables in San Andrés, Colombia

description: In San Andrés island, Colombia, in situ measurements of marine water quality and physical-chemical parameters around the island’s northeastern and northwestern zones were measured. For marine water quality, we aimed to observe the distribution of salinity, temperature, and heavy metals both at the surface and on the seabed, in addition to other water quality parameters in specific locations and times. For salinity and temperature, a salinity tester model HQ40d was used. We collected samples of seawater and brine which were analyzed in a laboratory for multiple other parameters, including heavy metals such as Cr and Cu, and the alkaline metal ion Mg. Last, CTD measurements showed variation along the water column in salinity and temperature, especially close to the brine discharge where should be expected greater salinity levels. This dataset has the potential to be useful for researchers, policymakers, and locals to raise awareness through data, modeling, and solutions for the water quality conditions under a brine discharge and a wastewater discharge.
DOI: 10.17632/gs6t6955jx.1
title: LINF_100017100

description: Arp2/3 complex subunit; Leishmania infantum (strain JPCM5)
DOI: 10.5517/ccdc.csd.cc2dr3cn
title: CCDC 2226741: Experimental Crystal Structure Determination

description: Related Article: V.V.Kovalev, V.A.Tafeenko|2025|CSD Communication|||
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.17632/pwdx6hxcv9.1
title: Demanufacturing of Thermoplastic Composites: Small Scale Experiments Exploring Ply Separation and Recovery

description: The data in this depository relates to the following open access publication:

Demanufacturing of thermoplastic composites: Small scale experiments exploring ply separation and recovery

Andrew J. Parsons
Michael S. Johnson
Samanta Piano
Davide S.A. De Focatiis

Composites Part A: Applied Science and Manufacturing

https://doi.org/10.1016/j.compositesa.2024.108626