cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/cc1jk55f
title: CCDC 1416674: Experimental Crystal Structure Determination

description: Related Article: Sami Dawaigher, Kristoffer Månsson, Erhad Ascic, Josep Artacho, Roger Mårtensson, Nagarajan Loganathan, Ola F. Wendt, Michael Harmata, Victor Snieckus, Kenneth Wärnmark|2015|J.Org.Chem.|80|12006|doi:10.1021/acs.joc.5b01921
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/cc1jk58j
title: CCDC 1416677: Experimental Crystal Structure Determination

description: Related Article: Nazia Kausar, Indranil Roy, Dipankar Chattopadhyay, Asish R. Das|2016|RSC Advances|6|22320|doi:10.1039/C6RA00388E
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: 10.15468/dl.7vzxsj
title: Occurrence Download

description: A dataset containing 41 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is Brazil",
 "OccurrenceStatus is Present",
 "TaxonKey is Naiadendron duckeanum"
 ]
}

 The dataset includes 41 records from 8 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0052343-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/ccdc.csd.cc1jk5qz
title: CCDC 1416691: Experimental Crystal Structure Determination

description: Related Article: Sidney Becker, Ines Thoma, Amrei Deutsch, Tim Gehrke, Peter Mayer, Hendrik Zipse, Thomas Carell|2016|Science|352|833|doi:10.1126/science.aad2808
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/cc1jk65g
title: CCDC 1416705: Experimental Crystal Structure Determination

description: Related Article: Annika Klose, Gerald Kehr, Constantin G. Daniliuc, Gerhard Erker|2016|Dalton Trans.|45|2023|doi:10.1039/C5DT03055B
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.cc1jk5t2
title: CCDC 1416694: Experimental Crystal Structure Determination

description: Related Article: William Cullen, M. Cristina Misuraca, Christopher A. Hunter, Nicholas H. Williams, Michael D. Ward|2016|Nature Chemistry|8|231|doi:10.1038/nchem.2452
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.17424213
title: Composition, interactions and resulting inhalation risk of micro- and nano-plastics in urban air

description: All the data related to "Composition, interactions and resulting inhalation risk of micro- and nano-plastics in urban air" with polymer concentrations, carbonaceous parameters, health risk assessments, meteorological parameters and blank values.
DOI: 10.5517/cc1jk66h
title: CCDC 1416706: Experimental Crystal Structure Determination

description: Related Article: Annika Klose, Gerald Kehr, Constantin G. Daniliuc, Gerhard Erker|2016|Dalton Trans.|45|2023|doi:10.1039/C5DT03055B
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/cc1jk67j
title: CCDC 1416707: Experimental Crystal Structure Determination

description: Related Article: Annika Klose, Gerald Kehr, Constantin G. Daniliuc, Gerhard Erker|2016|Dalton Trans.|45|2023|doi:10.1039/C5DT03055B
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.17424212
title: Composition, interactions and resulting inhalation risk of micro- and nano-plastics in urban air

description: All the data related to "Composition, interactions and resulting inhalation risk of micro- and nano-plastics in urban air" with polymer concentrations, carbonaceous parameters, health risk assessments, meteorological parameters and blank values.
DOI: 10.5517/cc1jk63d
title: CCDC 1416703: Experimental Crystal Structure Determination

description: Related Article: Mohamed M. Radwan, Amira S. Wanas, Frank R. Fronczek, Melissa R. Jacob, Samir A. Ross|2015|Med.Chem.Res.|24|3398|doi:10.1007/s00044-015-1386-9
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.17182178
title: CTG Classification with Machine Learning and Transformer Models: Python Scripts and Data

description: This repository contains the Python scripts and datasets used for the doctoral thesis study comparing classical machine learning (Cluster-A) and transformer-based (Cluster-B) models in the classification of cardiotocography (CTG) data.

Files and their purposes:





00_Split_Data.ipynb – Jupyter notebook for splitting the original CTG dataset into training, validation, and test subsets.




01_examdata.csv – Example raw dataset containing CTG signals and labels.




02_segmented.xlsx – Pre-processed and segmented CTG dataset ready for model input.




03_ClassicModels.ipynb – Implementation of classical machine learning algorithms (SVM-RBF, Random Forest, XGBoost, LightGBM, Logistic Regression) with evaluation metrics.




04_TransformersModel.ipynb – Implementation of transformer-based deep learning models (PatchCTG, PatchTST, iTransformer, TimesNetLite, ETCNN).




Result-A.txt – Output file summarizing performance metrics of classical machine learning models.




Result-B.txt – Output file summarizing performance metrics of transformer-based models.




_scored_output.xlsx – Final scored dataset with model predictions and evaluation results.



Scope:The provided scripts include data preprocessing and augmentation (balancing imbalanced classes using SMOTE and data augmentation techniques), training and validation workflows, and evaluation metrics (accuracy, precision, recall, F1-score, confusion matrices). Visualization utilities (ROC curves, classification reports, and model comparisons) are also integrated.

These resources are intended to support reproducibility and further research on the application of artificial intelligence models in fetal monitoring and obstetric anesthesia.
DOI: 10.5517/cc1j35jb
title: CCDC 1403231: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1jk64f
title: CCDC 1416704: Experimental Crystal Structure Determination

description: Related Article: Mohamed M. Radwan, Amira S. Wanas, Frank R. Fronczek, Melissa R. Jacob, Samir A. Ross|2015|Med.Chem.Res.|24|3398|doi:10.1007/s00044-015-1386-9
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/cc1j35kc
title: CCDC 1403232: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1j35ld
title: CCDC 1403233: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1j35mf
title: CCDC 1403234: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1j35ng
title: CCDC 1403235: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1j35ph
title: CCDC 1403236: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1j35qj
title: CCDC 1403237: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1j35rk
title: CCDC 1403238: Experimental Crystal Structure Determination

description: Related Article: Rong-Qing Zhao, Xing Liu, Jian Zhou, Hong-Ping Xiao, Hua-Hong Zou, Lianshe Fu, Qiuling Tang, Xiao-Feng Tan|2016|Dalton Trans.|45|6015|doi:10.1039/C5DT02188J
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/cc1jk6kv
title: CCDC 1416717: Experimental Crystal Structure Determination

description: Related Article: Andrea Cingolani, Cristiana Cesari, Stefano Zacchini, Valerio Zanotti, Maria Cristina Cassani, Rita Mazzoni|2015|Dalton Trans.|44|19063|doi:10.1039/C5DT03071D
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/cc1jk6lw
title: CCDC 1416718: Experimental Crystal Structure Determination

description: Related Article: Andrea Cingolani, Cristiana Cesari, Stefano Zacchini, Valerio Zanotti, Maria Cristina Cassani, Rita Mazzoni|2015|Dalton Trans.|44|19063|doi:10.1039/C5DT03071D
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/cc1jk6mx
title: CCDC 1416719: Experimental Crystal Structure Determination

description: Related Article: Andrea Cingolani, Cristiana Cesari, Stefano Zacchini, Valerio Zanotti, Maria Cristina Cassani, Rita Mazzoni|2015|Dalton Trans.|44|19063|doi:10.1039/C5DT03071D
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/cc1jk6ny
title: CCDC 1416720: Experimental Crystal Structure Determination

description: Related Article: Andrea Cingolani, Cristiana Cesari, Stefano Zacchini, Valerio Zanotti, Maria Cristina Cassani, Rita Mazzoni|2015|Dalton Trans.|44|19063|doi:10.1039/C5DT03071D
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/cc1jk6pz
title: CCDC 1416721: Experimental Crystal Structure Determination

description: Related Article: Andrea Cingolani, Cristiana Cesari, Stefano Zacchini, Valerio Zanotti, Maria Cristina Cassani, Rita Mazzoni|2015|Dalton Trans.|44|19063|doi:10.1039/C5DT03071D
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.cc1jk6v4
title: CCDC 1416726: Experimental Crystal Structure Determination

description: Related Article: M. Hummel, M. Markiewicz, S. Stolte, M. Noisternig, D. E. Braun, T. Gelbrich, U. J. Griesser, G. Partl, B. Naier, K. Wurst, B. Krüger, H. Kopacka, G. Laus, H. Huppertz, H. Schottenberger|2017|Green Chemistry|19|3225|doi:10.1039/C7GC00571G
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/cc1jk75h
title: CCDC 1416736: Experimental Crystal Structure Determination

description: Related Article: S.S. Baisya, B. Ghosh, P.S. Roy|2015|Acta Crystallogr.,Sect.E:Cryst.Commun.|71|m162|doi:10.1107/S2056989015014619
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.cc1jk6w5
title: CCDC 1416727: Experimental Crystal Structure Determination

description: Related Article: M. Hummel, M. Markiewicz, S. Stolte, M. Noisternig, D. E. Braun, T. Gelbrich, U. J. Griesser, G. Partl, B. Naier, K. Wurst, B. Krüger, H. Kopacka, G. Laus, H. Huppertz, H. Schottenberger|2017|Green Chemistry|19|3225|doi:10.1039/C7GC00571G
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/cc1jk8v6
title: CCDC 1416788: Experimental Crystal Structure Determination

description: Related Article: Peng Yang, Zhengguo Lin, Gabriela Alfaro-Espinoza, Matthias S. Ullrich, Ciprian I. Raţ, Cristian Silvestru, Ulrich Kortz|2016|Inorg.Chem.|55|251|doi:10.1021/acs.inorgchem.5b02189
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/cc1jk8w7
title: CCDC 1416789: Experimental Crystal Structure Determination

description: Related Article: Peng Yang, Zhengguo Lin, Gabriela Alfaro-Espinoza, Matthias S. Ullrich, Ciprian I. Raţ, Cristian Silvestru, Ulrich Kortz|2016|Inorg.Chem.|55|251|doi:10.1021/acs.inorgchem.5b02189
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/cc1jk8x8
title: CCDC 1416790: Experimental Crystal Structure Determination

description: Related Article: Peng Yang, Zhengguo Lin, Gabriela Alfaro-Espinoza, Matthias S. Ullrich, Ciprian I. Raţ, Cristian Silvestru, Ulrich Kortz|2016|Inorg.Chem.|55|251|doi:10.1021/acs.inorgchem.5b02189
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/cc1jk7fr
title: CCDC 1416744: Experimental Crystal Structure Determination

description: Related Article: Spencer P. Heins, Wesley D. Morris, Peter T. Wolczanski, Emil B. Lobkovsky, Thomas R. Cundari|2015|Angew.Chem.,Int.Ed.|54|14407|doi:10.1002/anie.201507463
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/cc1jk7gs
title: CCDC 1416745: Experimental Crystal Structure Determination

description: Related Article: Spencer P. Heins, Wesley D. Morris, Peter T. Wolczanski, Emil B. Lobkovsky, Thomas R. Cundari|2015|Angew.Chem.,Int.Ed.|54|14407|doi:10.1002/anie.201507463
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/cc1jk7ht
title: CCDC 1416746: Experimental Crystal Structure Determination

description: Related Article: Spencer P. Heins, Wesley D. Morris, Peter T. Wolczanski, Emil B. Lobkovsky, Thomas R. Cundari|2015|Angew.Chem.,Int.Ed.|54|14407|doi:10.1002/anie.201507463
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/cc1jk7jv
title: CCDC 1416747: Experimental Crystal Structure Determination

description: Related Article: Spencer P. Heins, Wesley D. Morris, Peter T. Wolczanski, Emil B. Lobkovsky, Thomas R. Cundari|2015|Angew.Chem.,Int.Ed.|54|14407|doi:10.1002/anie.201507463
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.