cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc20pcx0
title: CCDC 1867592: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pcy1
title: CCDC 1867593: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pcz2
title: CCDC 1867594: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pd04
title: CCDC 1867595: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pd15
title: CCDC 1867596: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pd26
title: CCDC 1867597: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pd48
title: CCDC 1867599: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pd59
title: CCDC 1867600: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pd6b
title: CCDC 1867601: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.2617257
title: Datasets of Listeria monocytogenes phenotypes colected in the EJP OH LISTADAPT project

description: LISTADAPT datasets

This repository gathered the phenotypic datasets in the LISTADAPT project (https://onehealthejp.eu/projects/jrp7-listadapt/)<br>
It includes the Listeria monocytogenes phenotypic data associated to:<br>
- biofilm formation<br>
- MIC of antimicrobials<br>
- Growth and survival in soil microsom<br>
- Growth and survival in stressed conditions (culture medium)

200 strains: 100 isolated in main RTE foods and 100 isolated from environment/farm/animals are studied.

A versionning of the files is proposed, permitting to determine the  more recent files in the repository.
DOI: 10.5281/zenodo.2617258
title: Datasets of Listeria monocytogenes phenotypes colected in the EJP OH LISTADAPT project

description: LISTADAPT datasets

This repository gathered the phenotypic datasets in the LISTADAPT project (https://onehealthejp.eu/projects/jrp7-listadapt/)<br>
It includes the Listeria monocytogenes phenotypic data associated to:<br>
- biofilm formation<br>
- MIC of antimicrobials<br>
- Growth and survival in soil microsom<br>
- Growth and survival in stressed conditions (culture medium)

200 strains: 100 isolated in main RTE foods and 100 isolated from environment/farm/animals are studied.

A versionning of the files is proposed, permitting to determine the  more recent files in the repository.
DOI: 10.5517/ccdc.csd.cc20pd7c
title: CCDC 1867602: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20pd8d
title: CCDC 1867603: Experimental Crystal Structure Determination

description: Related Article: Maria Książek, Marek Weselski, Maria Ilczyszyn, Joachim Kusz, Robert Bronisz|2019|Chem.-Eur.J.|25|2250|doi:10.1002/chem.201804721
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.cc20qbdh
title: CCDC 1868506: Experimental Crystal Structure Determination

description: Related Article: Haifeng Zheng, Yan Wang, Chaoran Xu, Qian Xiong, Lili Lin, Xiaoming Feng|2019|Angew.Chem.,Int.Ed.|58|5327|doi:10.1002/anie.201900421
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.cc204dh2
title: CCDC 1851273: Experimental Crystal Structure Determination

description: Related Article: Haifeng Zheng, Yan Wang, Chaoran Xu, Qian Xiong, Lili Lin, Xiaoming Feng|2019|Angew.Chem.,Int.Ed.|58|5327|doi:10.1002/anie.201900421
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.cc20v1gd
title: CCDC 1872073: Experimental Crystal Structure Determination

description: Related Article: C. Weck, E. Nauha, T. Gruber|2019|Cryst.Growth Des.|19|2899|doi:10.1021/acs.cgd.9b00116
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.cc20y202
title: CCDC 1874973: Experimental Crystal Structure Determination

description: Related Article: Juan P. Vizuet, Thomas S. Howlett, Abigail L. Lewis, Zachary D. Chroust, Gregory T. McCandless, Kenneth J. Balkus Junior
|2019|Inorg.Chem.|58|5031|doi:10.1021/acs.inorgchem.9b00077
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.cc20ybdq
title: CCDC 1875233: Experimental Crystal Structure Determination

description: Related Article: Xiong-Li Liu, Gen Zhou, Yi Gong, Zhen Yao, Xiong Zuo, Wen-Hui Zhang, Ying Zhou|2019|Org.Lett.|21|2528|doi:10.1021/acs.orglett.9b00139
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.cc210n7z
title: CCDC 1877460: Experimental Crystal Structure Determination

description: Related Article: Takuya Shiga, Daisuke Ishikawa, Minami Tachibana, Ryo Saiki, Graham N. Newton, Hiroki Oshio|2019|J.Magn.Magn.Mater.|485|16|doi:10.1016/j.jmmm.2019.03.101
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.cc211wff
title: CCDC 1878644: Experimental Crystal Structure Determination

description: Related Article: Steven M. Russell, Anthony M. Brewer, Dani M. Stoltzfus, Jaber Saghaei, Paul L. Burn|2019|J.Mater.Chem.C|7|4681|doi:10.1039/C8TC05703F
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.cc2126bp
title: CCDC 1878951: Experimental Crystal Structure Determination

description: Related Article: K.N. Brinda, Gautam Achar, Jan Grzegorz Małecki, Srinivasa Budagumpi, D.H. Nagaraju, V. Suvina, R. Geetha Balakrishna|2019|Biosens.Bioelectron.|134|24|doi:10.1016/j.bios.2019.03.057
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.cc2126cq
title: CCDC 1878952: Experimental Crystal Structure Determination

description: Related Article: K.N. Brinda, Gautam Achar, Jan Grzegorz Małecki, Srinivasa Budagumpi, D.H. Nagaraju, V. Suvina, R. Geetha Balakrishna|2019|Biosens.Bioelectron.|134|24|doi:10.1016/j.bios.2019.03.057
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.cc212cwd
title: CCDC 1879123: Experimental Crystal Structure Determination

description: Related Article: Tao Yang, Xian-Rong Song, Ren Li, Fengyan Jin, Yuxing Zhang, Jiang Bai, Ruchun Yang, Haixin Ding, Qiang Xiao|2019|Tetrahedron Lett.|60|1248|doi:10.1016/j.tetlet.2019.03.070
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.2618873
title: Evolutionary Analysis of Gaseous Sub-Neptune-mass Planets with MESA

description: MESA work directory, data, and ruby scripts associated with Evolutionary Analysis of Gaseous Sub-Neptune-mass Planets with MESA
DOI: 10.5281/zenodo.2618874
title: Evolutionary Analysis of Gaseous Sub-Neptune-mass Planets with MESA

description: MESA work directory, data, and ruby scripts associated with Evolutionary Analysis of Gaseous Sub-Neptune-mass Planets with MESA
DOI: 10.5517/ccdc.csd.cc215hd4
title: CCDC 1882115: Experimental Crystal Structure Determination

description: Related Article: Bidyut Kumar Kundu, Rishi Ranjan, Attreyee Mukherjee, Shaikh M. Mobin, Suman Mukhopadhyay|2019|J.Inorg.Biochem.|195|164|doi:10.1016/j.jinorgbio.2019.03.023
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.cc217ndc
title: CCDC 1884192: Experimental Crystal Structure Determination

description: Related Article: Tom Vancompernolle, Nicolas Merle, Frédéric Capet, Iker Del Rosal, Maron Laurent, Laurent Delevoye, Frédérique Pourpoint, Régis M. Gauvin|2019|Dalton Trans.|48|5243|doi:10.1039/C9DT00845D
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.cc218r69
title: CCDC 1885240: Experimental Crystal Structure Determination

description: Related Article: Zachary Dubrawski, Joshua Heidebrecht, Braulio M. Puerta Lombardi, Alexander S. Hyla, Janina Willkomm, Chase L. Radford, Jian-Bin Lin, Gregory C. Welch, Sathish Ponnurangam, Roland Roesler, Demyan E. Prokopchuk, Warren E. Piers|2019|Sustainable Energy Fuels|3|1172|doi:10.1039/C8SE00623G
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.cc218r7b
title: CCDC 1885241: Experimental Crystal Structure Determination

description: Related Article: Zachary Dubrawski, Joshua Heidebrecht, Braulio M. Puerta Lombardi, Alexander S. Hyla, Janina Willkomm, Chase L. Radford, Jian-Bin Lin, Gregory C. Welch, Sathish Ponnurangam, Roland Roesler, Demyan E. Prokopchuk, Warren E. Piers|2019|Sustainable Energy Fuels|3|1172|doi:10.1039/C8SE00623G
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.cc218r8c
title: CCDC 1885242: Experimental Crystal Structure Determination

description: Related Article: Zachary Dubrawski, Joshua Heidebrecht, Braulio M. Puerta Lombardi, Alexander S. Hyla, Janina Willkomm, Chase L. Radford, Jian-Bin Lin, Gregory C. Welch, Sathish Ponnurangam, Roland Roesler, Demyan E. Prokopchuk, Warren E. Piers|2019|Sustainable Energy Fuels|3|1172|doi:10.1039/C8SE00623G
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.cc219qlp
title: CCDC 1886182: Experimental Crystal Structure Determination

description: Related Article: Polly L. Arnold, Laura Puig-Urrea, Jordann A. L. Wells, Dan Yuan, Faye L. Cruickshank, Rowan D. Young|2019|Dalton Trans.|48|4894|doi:10.1039/C8DT05051A
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.cc219qmq
title: CCDC 1886183: Experimental Crystal Structure Determination

description: Related Article: Polly L. Arnold, Laura Puig-Urrea, Jordann A. L. Wells, Dan Yuan, Faye L. Cruickshank, Rowan D. Young|2019|Dalton Trans.|48|4894|doi:10.1039/C8DT05051A
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: 10.21227/awav-bn36
title: Simulated boiler data for fault detection and classification

description: An emulator for the Viessmann Vitorond 200 Gas Fired Boiler VD2 Series 380 dataset was created in Matlab/Simulink based on the Simscape boiler model. After validating with manufacturer test data, a series of faults (Excess air, ranging from 15% - 50%; fouling of the heat exchanger from 1% to 46%; and scaling of the water-side heat exchanger element from 1% to 46%, all in 5% increments) were simulated with this emulator, along with nominal operating conditons for a range of operational parameters (gas fuel rate from 1 kg/s to 4 kg/s, water mass flow rate from 3 kg/s to 12.5 kg/s and combustion air temperature from 283 K to 303 K).. A factorial sampling method was used, resulting in a total of 27,281 simulations. This dataset contains the points visible to a Building Automation System along with the Condition (detailed class) and Class (fault category).
DOI: 10.21227/0jgn-9k98
title: Simulated boiler data for fault detection and classification

description: An emulator for the Viessmann Vitorond 200 Gas Fired Boiler VD2 Series 380 dataset was created in Matlab/Simulink based on the Simscape boiler model. After validating with manufacturer test data, a series of faults (Excess air, ranging from 15% - 50%; fouling of the heat exchanger from 1% to 46%; and scaling of the water-side heat exchanger element from 1% to 46%, all in 5% increments) were simulated with this emulator, along with nominal operating conditons for a range of operational parameters (gas fuel rate from 1 kg/s to 4 kg/s, water mass flow rate from 3 kg/s to 12.5 kg/s and combustion air temperature from 283 K to 303 K).. A factorial sampling method was used, resulting in a total of 27,281 simulations. This dataset contains the points visible to a Building Automation System along with the Condition (detailed class) and Class (fault category).
DOI: 10.21227/8tq1-wy17
title: Simulated Boiler Fault Data

description: Matlab Simulink was used to develop an emulator for the Viessmann Vitorond 200 Gas Fired Boiler VD2 Series 380 and a series of faults were modeled along with normal data across the expected range of operation to create a labelled dataset with approximately 27,500 cases for training and testing boiler fault classification models.
DOI: 10.21227/ye8z-z608
title: Simulated Boiler Fault Data

description: Matlab Simulink was used to develop an emulator for the Viessmann Vitorond 200 Gas Fired Boiler VD2 Series 380 and a series of faults were modeled along with normal data across the expected range of operation to create a labelled dataset with approximately 27,500 cases for training and testing boiler fault classification models.
DOI: 10.5517/ccdc.csd.cc21bclc
title: CCDC 1886802: Experimental Crystal Structure Determination

description: Related Article: Polly L. Arnold, Laura Puig-Urrea, Jordann A. L. Wells, Dan Yuan, Faye L. Cruickshank, Rowan D. Young|2019|Dalton Trans.|48|4894|doi:10.1039/C8DT05051A
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.