cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc2dft8y
title: CCDC 2217810: Experimental Crystal Structure Determination

description: Related Article: Chandrima Maitra, Prakash D. Jadhav, Debashis Barik, Yeu-Shiuan Ho, Chu-Chun Cheng, Mu-Jeng Cheng, Yun-Wei Chiang, Rai-Shung Liu|2022|Org.Lett.|25|82|doi:10.1021/acs.orglett.2c03884
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.cc2dft9z
title: CCDC 2217811: Experimental Crystal Structure Determination

description: Related Article: Chandrima Maitra, Prakash D. Jadhav, Debashis Barik, Yeu-Shiuan Ho, Chu-Chun Cheng, Mu-Jeng Cheng, Yun-Wei Chiang, Rai-Shung Liu|2022|Org.Lett.|25|82|doi:10.1021/acs.orglett.2c03884
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.cc2dh9bk
title: CCDC 2219238: Experimental Crystal Structure Determination

description: Related Article: Ying Zhou, Xin Yue, Feng Jiang, Jianwei Sun, Wengang Guo|2023|Chem.Commun.|59|1193|doi:10.1039/D2CC06147C
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: 10.5281/zenodo.7571199
title: Atomic energy densities from the multiple radii functional (MRF)

description: This dataset contains exchange-correlation energy densities in the gauge of the electrostatic potential for various atomic systems, all in atomic units. The first column represents the distance from the nucleus in bohr, while the remaining columns represent the energy densities. The headings for the columns are specified in the first row of the dataset. The dataset includes the exact energy densities "w_0 [exact]" and "w_1 [exact]" which are taken from reference [Phys.Chem.Chem.Phys., 2017, 19, 6169]. These densities are calculated at the zero and full coupling strengths, respectively. The densities used to calculate the MRF functional are also taken from the same reference, where the computational details can be found. "w_1 [mrf original]" represents the MRF energy densities calculated using the original fluctuation function developed in reference [J. Phys. Chem. Lett. 2017, 8, 2799−2805]. "w_1 [mrf new]" represents the MRF energy densities calculated using a newly developed fluctuation function, specifically designed to satisfy the high-density limit, non-negativity of the correlation part of the energy densities, and the uniform electron gas limit. Files are given in the XLSX format and different file names represent different atoms (ions). Wolfram Mathematica 13.1.0.0. has been used for data curation.
DOI: 10.5281/zenodo.7571198
title: Atomic energy densities from the multiple radii functional (MRF)

description: This dataset contains exchange-correlation energy densities in the gauge of the electrostatic potential for various atomic systems, all in atomic units. The first column represents the distance from the nucleus in bohr, while the remaining columns represent the energy densities. The headings for the columns are specified in the first row of the dataset. The dataset includes the exact energy densities "w_0 [exact]" and "w_1 [exact]" which are taken from reference [Phys.Chem.Chem.Phys., 2017, 19, 6169]. These densities are calculated at the zero and full coupling strengths, respectively. The densities used to calculate the MRF functional are also taken from the same reference, where the computational details can be found. "w_1 [mrf original]" represents the MRF energy densities calculated using the original fluctuation function developed in reference [J. Phys. Chem. Lett. 2017, 8, 2799−2805]. "w_1 [mrf new]" represents the MRF energy densities calculated using a newly developed fluctuation function, specifically designed to satisfy the high-density limit, non-negativity of the correlation part of the energy densities, and the uniform electron gas limit. Files are given in the XLSX format and different file names represent different atoms (ions). Wolfram Mathematica 13.1.0.0. has been used for data curation.
DOI: 10.6084/m9.figshare.21959735
title: Raw data for plasticity response to high levels of nitrate.xlsx

description: plasticity response to high levels of nitrate
DOI: 10.6084/m9.figshare.21959735.v1
title: Raw data for plasticity response to high levels of nitrate.xlsx

description: plasticity response to high levels of nitrate
DOI: 10.34740/kaggle/dsv/4903115
title: Calgary Building Permit Values by Community
DOI: 10.18120/wv6p-4y43
title: New Test Subproject
DOI: 10.5517/ccdc.csd.cc2dbp2j
title: CCDC 2214797: Experimental Crystal Structure Determination

description: Related Article: Huixian Miao, Yujie Zhou, Pingping Wang, Zetao Huang, Wenjiang Zhaxi, Luying Liu, Fengnan Duan, Jinmin Wang, Xiao Ma, Shenlong Jiang, Wei Huang, Qun Zhang, Dayu Wu|2023|Chem.Commun.|59|1229|doi:10.1039/D2CC05921E
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.cc2dbp3k
title: CCDC 2214798: Experimental Crystal Structure Determination

description: Related Article: Huixian Miao, Yujie Zhou, Pingping Wang, Zetao Huang, Wenjiang Zhaxi, Luying Liu, Fengnan Duan, Jinmin Wang, Xiao Ma, Shenlong Jiang, Wei Huang, Qun Zhang, Dayu Wu|2023|Chem.Commun.|59|1229|doi:10.1039/D2CC05921E
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/4903261
title: OntoUML/UFO Catalog
DOI: 10.6084/m9.figshare.21929250.v3
title: Empirical Study on High Performance Computing (HPC) Performance Bug Analysis - Replication Package

description: Summary results of labeled data added.
DOI: 10.6084/m9.figshare.21965225
title: Dataset for: Comparison of the dynamics of exoskeletal-assisted and unassisted locomotion in an FDA-approved lower extremity device: Controlled experiments and development of a subject-specific virtual simulator

description: The dataset consists of three-dimensional marker trajectories, ground reaction forces, and electromyography information from exoskeletal-assisted and unassisted locomotion (walking, sit-to-stand, and stand-to-sit).
DOI: 10.6084/m9.figshare.21965225.v2
title: Dataset for: Comparison of the dynamics of exoskeletal-assisted and unassisted locomotion in an FDA-approved lower extremity device: Controlled experiments and development of a subject-specific virtual simulator

description: The dataset consists of three-dimensional marker trajectories, ground reaction forces, and electromyography information from exoskeletal-assisted and unassisted locomotion (walking, sit-to-stand, and stand-to-sit).
DOI: 10.6084/m9.figshare.21965225.v1
title: Datase for: Comparison of the dynamics of exoskeletal-assisted and unassisted locomotion in an FDA-approved lower extremity device: Controlled experiments and development of a subject-specific virtual simulator

description: The dataset consists of three-dimensional marker trajectories, ground reaction forces, and electromyography information from exoskeletal-assisted and unassisted locomotion (walking, sit-to-stand, and stand-to-sit).
DOI: 10.6084/m9.figshare.19914340.v3
title: OSS Newcomer comments - dataset

description: This is supplementary information and the dataset discussed in the paper 'Newcomers Assistance-Seeking during Open-Source Software Development: Dataset'. <br> Classified OSS newcomer comments dataset: <em>classified_newcomer_comments.csv</em> <br> Unclassified OSS newcomer comments: <em>unclassified_newcomer_comments.csv</em> <br> Codebook created using open coding, with examples for each code: <em>CodeBook.xlsx</em> <br> <em>Baseline models: baseline.zip</em> <br> <em>Human performance benchmark data: coder_agreement.xlsx</em>
DOI: 10.6084/m9.figshare.21965540
title: Rawdata.zip

description: Density-Flow.dat and Density-Velocity.dat are the raw data in Fig. 3 Syn-flow.dat and Syn-density.dat are the raw data in Fig. 4 Meandist.dat, Steplength.dat and Safedist are the raw data in Fig. 5 Syn-position and Syn-angles are the raw data in Fig. 6
DOI: 10.6084/m9.figshare.21965540.v1
title: Rawdata.zip

description: Density-Flow.dat and Density-Velocity.dat are the raw data in Fig. 3 Syn-flow.dat and Syn-density.dat are the raw data in Fig. 4 Meandist.dat, Steplength.dat and Safedist are the raw data in Fig. 5 Syn-position and Syn-angles are the raw data in Fig. 6
DOI: 10.6084/m9.figshare.21965540.v2
title: Rawdata.zip

description: Density-Flow.dat and Density-Velocity.dat are the raw data in Fig. 3 Syn-flow.dat and Syn-density.dat are the raw data in Fig. 4 Meandist.dat, Steplength.dat and Safedist are the raw data in Fig. 5 Syn-position and Syn-angles are the raw data in Fig. 6
DOI: 10.5519/qd.25e4i8ct
title: Query on the Natural History Museum Data Portal (data.nhm.ac.uk) (1 records)
DOI: 10.6084/m9.figshare.21965648
title: ZIP archive containing details of phylogenetic analysis from The Cambrian cirratuliform <i>Iotuba</i> denotes an early annelid radiation

description: Character descriptions, phylogenetic matrices, summary of results, and character mapping on a most parsimonious tree
DOI: 10.6084/m9.figshare.21965648.v1
title: ZIP archive containing details of phylogenetic analysis from The Cambrian cirratuliform <i>Iotuba</i> denotes an early annelid radiation

description: Character descriptions, phylogenetic matrices, summary of results, and character mapping on a most parsimonious tree
DOI: 10.6084/m9.figshare.21965654
title: Taxonomy from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Curated taxonomy for fungal ASVs
DOI: 10.6084/m9.figshare.21965654.v1
title: Taxonomy from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Curated taxonomy for fungal ASVs
DOI: 10.6084/m9.figshare.21965657
title: Supplementary code from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Code used in data processing, analysis and figure generation
DOI: 10.6084/m9.figshare.21965657.v1
title: Supplementary code from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Code used in data processing, analysis and figure generation
DOI: 10.6084/m9.figshare.21965660
title: Sample metadata from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Combined metadata for all samples
DOI: 10.6084/m9.figshare.21965660.v1
title: Sample metadata from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Combined metadata for all samples
DOI: 10.6084/m9.figshare.21965663
title: ASVs from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Unassigned ASV sequences
DOI: 10.6084/m9.figshare.21965663.v1
title: ASVs from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: Unassigned ASV sequences
DOI: 10.6084/m9.figshare.21965669
title: BLAST output from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: BLAST matches for fungal ASVs
DOI: 10.6084/m9.figshare.21965669.v1
title: BLAST output from A 17-year time-series of fungal environmental DNA from a coastal marine ecosystem reveals long-term seasonal-scale and inter-annual diversity patterns

description: BLAST matches for fungal ASVs
DOI: 10.6084/m9.figshare.21965681
title: ESM4: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum glenohumeral abduction-adduction moment arms for each muscle
DOI: 10.6084/m9.figshare.21965684
title: ESM8: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum elbow mediolateral long-axis rotation moment arms for each muscle
DOI: 10.6084/m9.figshare.21965684.v1
title: ESM8: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum elbow mediolateral long-axis rotation moment arms for each muscle
DOI: 10.6084/m9.figshare.21965687
title: ESM6: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum elbow extension-flexion moment arms for each muscle
DOI: 10.6084/m9.figshare.21965687.v1
title: ESM6: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum elbow extension-flexion moment arms for each muscle
DOI: 10.6084/m9.figshare.21965690
title: ESM2: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Muscle moment arms normalised to humeral circumference across all target postures
DOI: 10.6084/m9.figshare.21965690.v1
title: ESM2: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Muscle moment arms normalised to humeral circumference across all target postures
DOI: 10.6084/m9.figshare.21965693.v1
title: ESM11: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Correlations between key muscle moment arms and osteological measurements
DOI: 10.6084/m9.figshare.21965693
title: ESM11: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Correlations between key muscle moment arms and osteological measurements
DOI: 10.6084/m9.figshare.21965696
title: ESM5: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum glenohumeral mediolateral long-axis rotation moment arms for each muscle
DOI: 10.6084/m9.figshare.21965696.v1
title: ESM5: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum glenohumeral mediolateral long-axis rotation moment arms for each muscle
DOI: 10.6084/m9.figshare.21965699
title: ESM10: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: PCA inputs and outputs
DOI: 10.6084/m9.figshare.21965699.v1
title: ESM10: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: PCA inputs and outputs
DOI: 10.6084/m9.figshare.21965705
title: ESM9: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Sensitivity analysis moment arm data
DOI: 10.6084/m9.figshare.21965705.v1
title: ESM9: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Sensitivity analysis moment arm data
DOI: 10.6084/m9.figshare.21965708
title: ESM7: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum elbow abduction-adduction moment arms for each muscle
DOI: 10.6084/m9.figshare.21965708.v1
title: ESM7: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum elbow abduction-adduction moment arms for each muscle
DOI: 10.6084/m9.figshare.21965711
title: ESM3: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum glenohumeral protraction-retraction moment arms for each muscle
DOI: 10.6084/m9.figshare.21965711.v1
title: ESM3: from Convergent evolution of quadrupedality in ornithischian dinosaurs was achieved through disparate forelimb muscle mechanics

description: Mean, maximum, and minimum glenohumeral protraction-retraction moment arms for each muscle
DOI: 10.34740/kaggle/dsv/4903402
title: 💥📰 Daily Breaking News Twitter Dataset
DOI: 10.6084/m9.figshare.21399917
title: Predictability of daily streamflow for the great rivers of South America based on a simple metric

description: In this work, the role of initial conditions (ICs) and boundary conditions (BCs) in the predictability of natural flows of large river basins (&gt;1000 km<sup>2</sup>) in South America using the South American Large Basins Model (MGB-SA) was investigated. We proposed an analysis based on a simple metric: predictability was estimated by the number of days in which the streamflow forecasts performed above a given threshold. The role of ICs was assessed through null precipitation experiments and the role of BCs through climatological rainfall. For experiments with a Kling-Gupta efficiency metric and threshold of 0.95, the study shows that streamflow predictability from the ICs is relatively high (up to 40 days) in the main river reaches of flat-relief basins. The increase in predictability due to climatology-based BCs mostly occurs in areas with high predictability based on ICs. Basins with fast response present low streamflow predictability (up to three days).
DOI: 10.6084/m9.figshare.21399917.v2
title: Predictability of daily streamflow for the great rivers of South America based on a simple metric

description: In this work, the role of initial conditions (ICs) and boundary conditions (BCs) in the predictability of natural flows of large river basins (&gt;1000 km<sup>2</sup>) in South America using the South American Large Basins Model (MGB-SA) was investigated. We proposed an analysis based on a simple metric: predictability was estimated by the number of days in which the streamflow forecasts performed above a given threshold. The role of ICs was assessed through null precipitation experiments and the role of BCs through climatological rainfall. For experiments with a Kling-Gupta efficiency metric and threshold of 0.95, the study shows that streamflow predictability from the ICs is relatively high (up to 40 days) in the main river reaches of flat-relief basins. The increase in predictability due to climatology-based BCs mostly occurs in areas with high predictability based on ICs. Basins with fast response present low streamflow predictability (up to three days).
DOI: 10.6084/m9.figshare.21552341
title: Post-seismic mountain aquifer leakage drives multi-annual forearc basin recharge in the Atacama Desert

description: In response to a 7.8 M<sub>wb</sub> earthquake in June 2005 in the hyper-arid Atacama Desert, post-seismic mountain aquifer leakage was triggered at several sites. By creating data-driven models for selected water level time series, previously unconsidered processes of post-seismic mountain aquifer leakage are analysed. Post-event lag-time changes imply that the hydraulic conductivity of the assessed mountain aquifer doubled in response to the earthquake, initiating a multi-year period of augmented mountain-block recharge to the forearc basin. An estimate of the magnitude of mountain water releases after June 2005 suggests that released storage water exceeded the recharge provided by a 100-year rainfall event by fourfold. During an observation period of 43 years, two such events likely occurred in the study area. The frequency of post-seismic mountain aquifer leakage, its contribution to draining eventual head decays in the Atacama Desert and its importance for forearc basin water budgets are discussed.
DOI: 10.6084/m9.figshare.21552341.v2
title: Post-seismic mountain aquifer leakage drives multi-annual forearc basin recharge in the Atacama Desert

description: In response to a 7.8 M<sub>wb</sub> earthquake in June 2005 in the hyper-arid Atacama Desert, post-seismic mountain aquifer leakage was triggered at several sites. By creating data-driven models for selected water level time series, previously unconsidered processes of post-seismic mountain aquifer leakage are analysed. Post-event lag-time changes imply that the hydraulic conductivity of the assessed mountain aquifer doubled in response to the earthquake, initiating a multi-year period of augmented mountain-block recharge to the forearc basin. An estimate of the magnitude of mountain water releases after June 2005 suggests that released storage water exceeded the recharge provided by a 100-year rainfall event by fourfold. During an observation period of 43 years, two such events likely occurred in the study area. The frequency of post-seismic mountain aquifer leakage, its contribution to draining eventual head decays in the Atacama Desert and its importance for forearc basin water budgets are discussed.
DOI: 10.6084/m9.figshare.21399917.v1
title: Predictability of daily streamflow for the great rivers of South America based on a simple metric

description: In this work, the role of the initial conditions (ICs) and boundary conditions (BCs) on the predictability of natural flows of large basins rivers (&gt;1000km<sup>2</sup>) in South America from the MGB-SA (South American Large Basins Model) was investigated. We proposed an analysis based on a simple metric: predictability was estimated by the number of days the streamflow forecasts had a performance greater than a threshold. The role of ICs was assessed through null precipitation experiments and the role of BCs trough climatological rainfall. For the experiments with the Kling-Gupta efficiency metric and threshold of 0.95, the study shows that streamflow predictability from the ICs is relatively high (up to 40 days) in the main river reaches of flat relief basins. The increase in predictability due to climatology-based BCs mostly occur in areas with high predictability based on ICs. Basins with fast response present low streamflow predictability (up to three days).