cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc28jmgx
title: CCDC 2101349: Experimental Crystal Structure Determination

description: Related Article: Jun Zheng, Lin Zhang, Yuhe Chen, Yue Ma, Xue Dai, Li Shi, Yanli Lu, Xinan Yang, Peihua Ma|2022|J.Chem.Res.|46|174751982211063|doi:10.1177/17475198221106398
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.cc28ytkm
title: CCDC 2114031: Experimental Crystal Structure Determination

description: Related Article: Sudhakar Ganta, Jan-Hendrik Borter, Christoph Drechsler, Julian J. Holstein, Dirk Schwarzer, Guido H. Clever|2022|Org.Chem.Front.|9|5485|doi:10.1039/D2QO01339H
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.cc2bzjgb
title: CCDC 2174292: Experimental Crystal Structure Determination

description: Related Article: Ao-gang Liu, Yuan Chen, Peng-da Liu, Wei Qi, Bao Li|2022|Inorg.Chem.Front.|9|4425|doi:10.1039/D2QI01118B
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: 10.34740/kaggle/dsv/6088960
title: Egypt Gold Prices | Daily Updated
DOI: 10.5281/zenodo.8119634
title: Improving nitrogen cycling in a land surface model (CLM5) to quantify soil N2O, NO and NH3 emissions from enhanced rock weathering with croplands

description: This repository contains CLM5 model soil nitrogen (N2O, NO and NH3) output and metadata, and soil N<sub>2</sub>O fluxes from the Energy Farm ERW field trials used in the paper "Improving nitrogen cycling in a land surface model (CLM5) to quantify soil N2O, NO and NH3 emissions from enhanced rock weathering with croplands" (https://gmd.copernicus.org/preprints/gmd-2023-47/).
DOI: 10.5281/zenodo.8119633
title: Improving nitrogen cycling in a land surface model (CLM5) to quantify soil N2O, NO and NH3 emissions from enhanced rock weathering with croplands

description: This repository contains CLM5 model soil nitrogen (N2O, NO and NH3) output and metadata, and soil N<sub>2</sub>O fluxes from the Energy Farm ERW field trials used in the paper "Improving nitrogen cycling in a land surface model (CLM5) to quantify soil N2O, NO and NH3 emissions from enhanced rock weathering with croplands" (https://gmd.copernicus.org/preprints/gmd-2023-47/).
DOI: 10.5517/ccdc.csd.cc2bv2y7
title: CCDC 2170029: Experimental Crystal Structure Determination

description: Related Article: Geng Tan, Ruo-Qin Jia, Xin Zhao, Yu-Qiong Guo, Li-Lei Zhang, Xiao-Han Wang, Jian-Ge Wang, Xun Feng, Bo Li, Li-Ya Wang|2022|Inorg.Chem.|61|11866|doi:10.1021/acs.inorgchem.2c01619
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.cc2c0d93
title: CCDC 2175124: Experimental Crystal Structure Determination

description: Related Article: Qian Teng, Yan-Ping He, Shu-Mei Chen, Jian Zhang|2022|Dalton Trans.|51|11612|doi:10.1039/D2DT01976K
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: 10.5258/soton/d2641
title: Data for Doctoral thesis'Towards realistic large-scale simulations of fixed bed chemical reactors: Bridging the gap between discrete element and porous media computational fluid dynamics models'

description: Data submitted for doctoral thesis 1) filename: Chapter_3_Fig_Data -&gt; Excel file, with the data for Figure A.10 presented in Appendix C 2) Chapter_4_Fig_Data -&gt; Excel file, data for all figures in Chapter 4 of the thesis. 3) Chapter_5_Fig_Data -&gt; Excel file, data for all figures in Chapter 5 of the thesis. 4) 5S_beds_analysis_Avizo_method -&gt; Excel file, containing all data of the 5S 100-300, 300-500, and 500-700 particles. 5) Bed_Characteristics_Avizo_method_v4 -&gt; Excel file, containing all data of the 1S 100-300, 300-500, and 500-700 particles. 6) Chapter_6_Fig_Data -&gt; Excel file, kinetic data derivation for the Ethanol dehydration reaction used in Chapter 6, shown in Appendix B7. 7) Profiles_Comparison_DEM_SR -&gt; Excel file, containing all data for the radial profiles of all parameters of Chapter 6, for all three DEM, PM, and SR models. 8) Parallel_Profiles_Comparison_DEM_SR -&gt; Excel file, containing all data for the axial profiles of all parameters of Chapter 6, for all three DEM, PM, and SR models. 9) Parametric_Studies -&gt; Excel file, containing all data for the parametric studies related to Chapter 6, i.e., mesh independency study (Sheet "Mesh"), intraparticle porosity (Sheet "Porosity"), temperature (Sheet "Temperature" and "Bed-Temperature" for the 1- and 27-particle cases, respectively), WHSV (Sheet "WHSV" and "Bed - WHSV" for the 1- and 27-particle cases, respectively), and exothermicity (Sheet "Exothermicity"). 10) Comp_time_Complete -&gt; Excel file, data for the computational resources of all cases of Chapter 6, i.e., Table 6.2, Figure 6.30, and section F.9 11) Final_cases_DEM_vs_SR -&gt; PowerPoint presentation containing all contour plots of figure 6 Associated publications: The data of Chapter 4 has been published in the paper: DOI: 10.1039/D0FD00136H The data of Chapter 5 has been published in the paper: DOI: 10.1016/j.apt.2022.103932 Contributors for data collection: 1) Matthew E. Potter, Orchid ID: 0000-0001-9849-3306, for help with the 5S catalytic beds of Chapter 5 2) Katy Rankin, Orchid ID: 0000-0002-8458-1038, for doing the Computed Tomography (CT) scans of the catalytic beds of Chapter 5.
DOI: 10.5281/zenodo.8119557
title: Scope_1_and_2_emissons_2019

description: Scope 1 and 2 emissions from the food chain from 2019
DOI: 10.5281/zenodo.8119556
title: Scope_1_and_2_emissons_2019

description: Scope 1 and 2 emissions from the food chain from 2019
DOI: 10.21942/uva.16669363
title: Protein intake, diet quality and nutritional status in preprocedural Transcatheter Aortic Valve Implantation (TAVI) patients

description: Diagnosed prevalence of malnutrition and dietary intake were unknown in patients with severe aortic stenosis planned to undergo Transcatheter Aortic Valve Implantation (TAVI). This dataset was used to describe the preprocedural nutritional status, protein intake and diet quality.<br> <br> The study has an observative cross sectional design. In total, 50 preprocedural TAVI patients participated and were included from May 2019 until January 2020. Nutritional status was diagnosed with the Global Leadership Initiative on Malnutrition (GLIM) criteria. Protein intake and diet quality were assessed with a three day dietary record. This project has the following items: <br> 1. Template dietary record 2. Data of dietary records from all patients (only in Dutch)<br> 3. NEVO table 2016<br> 4. Standard Operating Procedure how the food diaries can be converted to nutrient intake 5. R Syntax to convert dietary records into nutrient intake<br> 6. Export of the castor database, containing patient baseline characteristics nutritional status data and nutrition intake data 8. Data dictionary<br> 9. Readme file <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl, Cardiology, Amsterdam UMC, Meibergdreef 9, 1105AZ Amsterdam, The Netherlands.<br> <br> <br> <br>
DOI: 10.21942/uva.16669363.v2
title: Protein intake, diet quality and nutritional status in preprocedural Transcatheter Aortic Valve Implantation (TAVI) patients

description: Diagnosed prevalence of malnutrition and dietary intake were unknown in patients with severe aortic stenosis planned to undergo Transcatheter Aortic Valve Implantation (TAVI). This dataset was used to describe the preprocedural nutritional status, protein intake and diet quality.<br> <br> The study has an observative cross sectional design. In total, 50 preprocedural TAVI patients participated and were included from May 2019 until January 2020. Nutritional status was diagnosed with the Global Leadership Initiative on Malnutrition (GLIM) criteria. Protein intake and diet quality were assessed with a three day dietary record. This project has the following items: <br> 1. Template dietary record 2. Data of dietary records from all patients (only in Dutch)<br> 3. NEVO table 2016<br> 4. Standard Operating Procedure how the food diaries can be converted to nutrient intake 5. R Syntax to convert dietary records into nutrient intake<br> 6. Export of the castor database, containing patient baseline characteristics nutritional status data and nutrition intake data 8. Data dictionary<br> 9. Readme file <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl, Cardiology, Amsterdam UMC, Meibergdreef 9, 1105AZ Amsterdam, The Netherlands.<br> <br> <br> <br>
DOI: 10.21942/uva.17104514
title: Low muscle mass and muscle quality are associated with mortality after Transcatheter Aortic Valve Implantation

description: Not all patients with severe aortic valve stenosis benefit from Transcatheter Aortic Valve Implantation (TAVI). Especially frail patients, with low resilience due to low muscle mass or muscle quality may be at risk of mortality, despite a technically successful procedure.<br> Aim of this study is to determine if automatically assessed muscle mass and muscle quality are associated with long-term mortality after TAVI. <br> The study had an observation design. Including 1405 patients with servere aortic stenosis undergoing TAVI, from January 2010 until January 2020. With the deep-learning software of Quantib (research.quantib.com) muscle area, average density of muscle area in Hounsfield Units and Intermuscular Adipose Tissue was determined. Patients were followed for approximately 5-year. <br> 1. Data of study <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl, Cardiology, Amsterdam UMC, Meibergdreef 9, 1105AZ Amsterdam, The Netherlands. <br> Syntax used for analysis can be found on GitHub: https://github.com/Dennisvanerck/Quantib_mortality <br>
DOI: 10.21942/uva.17104514.v1
title: Low muscle mass and muscle quality are associated with mortality after Transcatheter Aortic Valve Implantation

description: Not all patients with severe aortic valve stenosis benefit from Transcatheter Aortic Valve Implantation (TAVI). Especially frail patients, with low resilience due to low muscle mass or muscle quality may be at risk of mortality, despite a technically successful procedure.<br> Aim of this study is to determine if automatically assessed muscle mass and muscle quality are associated with long-term mortality after TAVI. <br> The study had an observation design. Including 1405 patients with servere aortic stenosis undergoing TAVI, from January 2010 until January 2020. With the deep-learning software of Quantib (research.quantib.com) muscle area, average density of muscle area in Hounsfield Units and Intermuscular Adipose Tissue was determined. Patients were followed for approximately 5-year. <br> 1. Data of study <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl, Cardiology, Amsterdam UMC, Meibergdreef 9, 1105AZ Amsterdam, The Netherlands. <br> Syntax used for analysis can be found on GitHub: https://github.com/Dennisvanerck/Quantib_mortality <br>
DOI: 10.21942/uva.19403444
title: Evaluation of a fully automatic deep learning-based method for the measurement of psoas muscle area

description: Study data used for evaluation of a fully automatic deep learning-based method for the measurement of psoas muscle area doi:10.3389/fnut.2022.781860 <br> This project has the following items <br> 1. Data of the study 2. Syntax used for analysis <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl
DOI: 10.21942/uva.19403444.v1
title: Evaluation of a fully automatic deep learning-based method for the measurement of psoas muscle area

description: Study data used for evaluation of a fully automatic deep learning-based method for the measurement of psoas muscle area doi:10.3389/fnut.2022.781860 <br> This project has the following items <br> 1. Data of the study 2. Syntax used for analysis <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl
DOI: 10.21942/uva.21347016
title: Physical functioning and Quality of Life in TAVI

description: Improved survival status is not the only reason for patients with severe aortic stenosis to undergo transcatheter aortic valve implementation (TAVI). Improved physical functioning, health status, and quality of life are evenly important treatment goals. We aim to determine the course of these conditions from before until six months after the TAVI procedure.<br> <br> We collected data on: -Patient characteristics (e.g. age, sex, medical history) -Body composition(BIA) -Cognition (MMSE) -Health status (e.g. symptoms of severe aortic stenosis) -Quality of Life (EQ5D) -Handgrip strength -Cardiac anxiety (CAQ) -Lower body functioning (SPPB) -Loneliness (Jonggierveldscale) -Depression (GDS) -Amsterdam lineair disability scale -Two minute step test score -Nutritional status (MNA-SF) -Physical activity (Steps/day) <br> This repository storages the dataset of the cohort including 112 TAVI patients. <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl
DOI: 10.21942/uva.21347016.v2
title: Physical functioning and Quality of Life in TAVI

description: Improved survival status is not the only reason for patients with severe aortic stenosis to undergo transcatheter aortic valve implementation (TAVI). Improved physical functioning, health status, and quality of life are evenly important treatment goals. We aim to determine the course of these conditions from before until six months after the TAVI procedure.<br> <br> We collected data on: -Patient characteristics (e.g. age, sex, medical history) -Body composition(BIA) -Cognition (MMSE) -Health status (e.g. symptoms of severe aortic stenosis) -Quality of Life (EQ5D) -Handgrip strength -Cardiac anxiety (CAQ) -Lower body functioning (SPPB) -Loneliness (Jonggierveldscale) -Depression (GDS) -Amsterdam lineair disability scale -Two minute step test score -Nutritional status (MNA-SF) -Physical activity (Steps/day) <br> This repository storages the dataset of the cohort including 112 TAVI patients. <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl
DOI: 10.21942/uva.21347016.v1
title: Physical functioning and Quality of Life in TAVI

description: Improved survival status is not the only reason for patients with severe aortic stenosis to undergo transcatheter aortic valve implementation (TAVI). Improved physical functioning, health status, and quality of life are evenly important treatment goals. We aim to determine the course of these conditions from before until six months after the TAVI procedure.<br> <br> We collected data on: -Patient characteristics (e.g. age, sex, medical history) -Body composition(BIA) -Cognition (MMSE) -Health status (e.g. symptoms of severe aortic stenosis) -Quality of Life (EQ5D) -Handgrip strength -Cardiac anxiety (CAQ) -Lower body functioning (SPPB) -Loneliness (Jonggierveldscale) -Depression (GDS) -Amsterdam lineair disability scale -Two minute step test score -Nutritional status (MNA-SF) -Physical activity (Steps/day) <br> This repository storages the dataset of the cohort including 112 TAVI patients. <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: Dennis van Erck, d.vanerck@amsterdamumc.nl.
DOI: 10.21942/uva.22360003
title: Exploring barriers and facilitators of behavioural changes in dietary intake and physical activity: a qualitative study in older adults undergoing transcatheter aortic valve implantation

description: The majority of older patients, scheduled for a cardiac procedure, do not adhere to international dietary intake and physical activity guidelines. The purpose of this study was to explore barriers and facilitators regarding dietary intake and physical activity behaviour change in older patients undergoing transcatheter aortic valve implantation (TAVI). <br> This respitory contains interviews (in dutch) conducted for the study: "Exploring barriers and facilitators of behavioural changes in dietary intake and physical activity: a qualitative study in older adults undergoing transcatheter aortic valve implantation." DOI: 10.1007/s41999-023-00774-1 <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl, Cardiology, Amsterdam UMC, Meibergdreef 9, 1105AZ Amsterdam, The Netherlands.
DOI: 10.21942/uva.22360003.v1
title: Exploring barriers and facilitators of behavioural changes in dietary intake and physical activity: a qualitative study in older adults undergoing transcatheter aortic valve implantation

description: The majority of older patients, scheduled for a cardiac procedure, do not adhere to international dietary intake and physical activity guidelines. The purpose of this study was to explore barriers and facilitators regarding dietary intake and physical activity behaviour change in older patients undergoing transcatheter aortic valve implantation (TAVI). <br> This respitory contains interviews (in dutch) conducted for the study: "Exploring barriers and facilitators of behavioural changes in dietary intake and physical activity: a qualitative study in older adults undergoing transcatheter aortic valve implantation." DOI: 10.1007/s41999-023-00774-1 <br> Because of the sensitive nature of the data, the data is confidential and will be shared only under strict conditions. For more information contact: cardiol@amsterdamumc.nl, Cardiology, Amsterdam UMC, Meibergdreef 9, 1105AZ Amsterdam, The Netherlands.
DOI: 10.17617/4.cc
title: Silicon-Vacancy Nanodiamonds as High Performance Near-Infrared Emitters for Live-Cell Dual-Color Imaging and Thermometry

description: This contains the Raw Data and Processed Data of: Liu, W., Alam, M. N. A., Liu, Y., Agafonov, V. N., Qi, H., Koynov, K., et al. (2022). Silicon-Vacancy Nanodiamonds as High Performance Near-Infrared Emitters for Live-Cell Dual-Color Imaging and Thermometry. Nano Letters, 22(7), 2881-2888. doi:10.1021/acs.nanolett.2c00040.
DOI: 10.14469/hpc/12235
title: test

description: Gaussian 16 (C01) calculation
DOI: 10.34740/kaggle/dsv/6089121
title: Global Genomic Neurofibromatosis Neoplasia
DOI: 10.6084/m9.figshare.23634624
title: Datos estudio Sergio.sav

description: Study participants (206) consisted of adult individuals who voluntarily enrolled in an 8-week MBSR program.
DOI: 10.25345/c5mc8rs48
title: MassIVE MSV000092351 - GNPS Massilia sp. NR 4-1 Raw extract
title: Raw extract of Massilia sp. NR 4-1 cultivated for 1 week in 100 mL R2A medium at 30C, 180 rpm. Extraction via XAD-7.
DOI: 10.17617/4.cd
title: Nanoscale patterning of polymers on DNA origami

description: This contains the Raw Data and Processed Data of: Alleva, N.; Winterwerber, P.; Whitfield, C. J.; Ng, D. Y. W.; Weil T.; Nanoscale Patterning of Polymers on DNA-Origami. Journal of Materials Chemistry B 2022, 10, 7512–7517. doi.org/10.1039/D2TB00812B
DOI: 10.6084/m9.figshare.23634678
title: CT_DT data_Rawlings et al..xlsx

description: The is behavioural data from a sample of UK adult participants who completed the remote associations test, as well as an alternate uses task. The latter comprises originality, fluency, elaboration and a summed score of each of these three.
DOI: 10.5258/soton/d2471
title: Data supporting the article "Microwave-enabled wearables: Underpinning technologies, integration platforms, and next-generation roadmap".

description: This dataset summarizes the WPT comparison data reported in Figures 5 and 6 of the article Microwave-enabled wearables: Underpinning technologies, integration platforms, and next-generation roadmap Published in IEEE Journal of Microwaves
DOI: 10.25625/va9uyr
title: menoci Software Source Code Distribution, Release 1.1

description: menoci Software Source Code Distribution, Release 1.1
DOI: 10.25377/sussex.21641795
title: Research data for paper: Thorium- and Uranium-Mediated C–H Activation of a Silyl-Substituted Cyclobutadienyl Ligand

description: Data for paper published in Inorganic Chemistry Dec 2022 <br> CIF files and checkcif files for all compounds. <br> Abstract Cyclobutadienyl complexes of the f-elements are a relatively new yet poorly understood class of sandwich and half-sandwich organometallic compounds. We now describe cyclobutadienyl transfer reactions of the magnesium reagent [(η4-Cb'''')Mg(THF)3] (<strong>1</strong>), where Cb'''' is tetrakis(trimethylsilyl)cyclobutadienyl, toward thorium(IV) and uranium(IV) tetrachlorides. The 1:1 stoichiometric reactions between <strong>1</strong> and AnCl4 proceed with intact transfer of Cb'''' to give the half-sandwich complexes [(η4-Cb'''')AnCl(μ-Cl)3Mg(THF)3] (An = Th, <strong>2</strong>; An = U, <strong>3</strong>). Using a 2:1 reaction stoichiometry produces [Mg2Cl3(THF)6][(η4-Cb'''')An(η3-C4H(SiMe3)3-κ-(CH2SiMe2)(Cl)] (An = Th, [Mg2Cl3(THF)6][<strong>4</strong>]; An = U [Mg2Cl3(THF)6][<strong>5</strong>]), in which one Cb'''' ligand has undergone cyclometalation of a trimethylsilyl group, resulting in the formation of an An–C σ-bond, protonation of the four-membered ring, and an η3-allylic interaction with the actinide. Complex solution-phase dynamics are observed with multinuclear nuclear magnetic resonance spectroscopy for both sandwich complexes. A computational analysis of the reaction mechanism leading to the formation of <strong>4</strong> and <strong>5</strong> indicates that the cyclobutadienyl ligands undergo C–H activation across the actinide center.