cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc24jbdf
title: CCDC 1981904: Experimental Crystal Structure Determination

description: Related Article: Hammed Olawale Oloyede, Joseph Anthony Orighomisan Woods, Helmar Görls, Winfried Plass, Abiodun Omokehinde Eseola|2025|CSD Communication|||
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.15468/dl.8ptx3w
title: Occurrence Download

description: A dataset containing 637 species occurrences available in GBIF matching the query:
{
 "and" : [
 "GadmGid is CHN.29_1",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "OccurrenceStatus is Present",
 "TaxonKey is Myophonus caeruleus"
 ]
}

 The dataset includes 637 records from 5 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0000012-260225131425191/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.cc2gt6fy
title: CCDC 2288340: Experimental Crystal Structure Determination

description: Related Article: Dan Luo, Chen-Hui Liu, Yi-Bo Chen, San-Tai Wang, Wei-Hui Fang, Jian Zhang|2024|Adv. Sci.|11|2305833|doi:10.1002/advs.202305833
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.cc2gt6gz
title: CCDC 2288341: Experimental Crystal Structure Determination

description: Related Article: Dan Luo, Chen-Hui Liu, Yi-Bo Chen, San-Tai Wang, Wei-Hui Fang, Jian Zhang|2024|Adv. Sci.|11|2305833|doi:10.1002/advs.202305833
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.cc2hnnzt
title: CCDC 2313777: Experimental Crystal Structure Determination

description: Related Article: Daniel Pilz, Helmar Görls, Sven Rau|2023|CSD Communication|||
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2l1k9j
title: CCDC 2384777: Experimental Crystal Structure Determination

description: Related Article: Lanxiang Liu, Yunfeng Tao, Yulin Song, Xiaojian Zhou, Guanben Du, Bei Zhou, Jun Lin|2026|New J.Chem.|||doi:10.1039/d5nj04764a
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.cc2lqqrt
title: CCDC 2405127: Experimental Crystal Structure Determination

description: Related Article: Victor M. Espinoza Castro, Saber Mirzaei, Mohammad Bilal, Gabriella N. Ruiz, Michael J. Rose, Xu Wang, Raúl Hernández Sánchez|2025|Angew.Chem.,Int.Ed.|64||doi:10.1002/anie.202511093
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.cc2m57jl
title: CCDC 2418109: Experimental Crystal Structure Determination

description: Related Article: Rong-De He, Qi Cao, Yixin Lu|2026|ACS Catalysis|||doi:10.1021/acscatal.5c08795
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.18746387
title: PhyGHT Dataset: Simulated Top Quark Pair Production for HL-LHC Pileup Mitigation

description: This repository contains the official dataset for the paper "PhyGHT: Physics-Guided Hypergraph Transformer for Signal Purification at the HL-LHC".

It consists of simulated proton-proton collision events of top quark pair production (ttbar) designed to model the extreme conditions of the High-Luminosity LHC (HL-LHC). The dataset is specifically curated to mitigate pileup.

Dataset ContentThe repository includes two distinct datasets representing different pileup (noise) scenarios:1. Standard LHC: Average interactions per bunch crossing (mu) = 60.2. Extreme HL-LHC: Average interactions per bunch crossing (mu) = 200.

Each dataset contains 10,000 events, with ground-truth labels for jets and tracks.

Data StructureThe data is provided in Python pickle (.pkl) format. Each file contains a nested dictionary with the following keys:



jets: Feature array [N_events, N_jets, N_features] containing aggregated jet kinematics and truth labels for Energy/Mass correction.

trks: Feature array [N_events, N_tracks, N_features] containing particle kinematics, impact parameters, and truth labels for track signal/noise classification.

jet_trk_IDs: A mapping list that links specific tracks to their parent jets.


Code AvailabilityThe official PyTorch implementation and detailed dataset walkthrough and description are available at:https://github.com/rAIson-Lab/PhyGHT
DOI: 10.5281/zenodo.18746388
title: PhyGHT Dataset: Simulated Top Quark Pair Production for HL-LHC Pileup Mitigation

description: This repository contains the official dataset for the paper "PhyGHT: Physics-Guided Hypergraph Transformer for Signal Purification at the HL-LHC".

It consists of simulated proton-proton collision events of top quark pair production (ttbar) designed to model the extreme conditions of the High-Luminosity LHC (HL-LHC). The dataset is specifically curated to mitigate pileup.

Dataset ContentThe repository includes two distinct datasets representing different pileup (noise) scenarios:1. Standard LHC: Average interactions per bunch crossing (mu) = 60.2. Extreme HL-LHC: Average interactions per bunch crossing (mu) = 200.

Each dataset contains 10,000 events, with ground-truth labels for jets and tracks.

Data StructureThe data is provided in Python pickle (.pkl) format. Each file contains a nested dictionary with the following keys:



jets: Feature array [N_events, N_jets, N_features] containing aggregated jet kinematics and truth labels for Energy/Mass correction.

trks: Feature array [N_events, N_tracks, N_features] containing particle kinematics, impact parameters, and truth labels for track signal/noise classification.

jet_trk_IDs: A mapping list that links specific tracks to their parent jets.


Code AvailabilityThe official PyTorch implementation and detailed dataset walkthrough and description are available at:https://github.com/rAIson-Lab/PhyGHT
DOI: 10.5517/ccdc.csd.cc2mbxws
title: CCDC 2423576: Experimental Crystal Structure Determination

description: Related Article: Yongqiang Xu, Wenkai Li, Xiaoli Gu, Yuhan Zhou, Jingping Qu, Baomin Wang|2026|Chem.Commun.|62|4545|doi:10.1039/d5cc06578j
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.cc2mbxxt
title: CCDC 2423577: Experimental Crystal Structure Determination

description: Related Article: Yongqiang Xu, Wenkai Li, Xiaoli Gu, Yuhan Zhou, Jingping Qu, Baomin Wang|2026|Chem.Commun.|62|4545|doi:10.1039/d5cc06578j
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.cc2mbxyv
title: CCDC 2423578: Experimental Crystal Structure Determination

description: Related Article: Yongqiang Xu, Wenkai Li, Xiaoli Gu, Yuhan Zhou, Jingping Qu, Baomin Wang|2026|Chem.Commun.|62|4545|doi:10.1039/d5cc06578j
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.cc2mbxzw
title: CCDC 2423579: Experimental Crystal Structure Determination

description: Related Article: Yongqiang Xu, Wenkai Li, Xiaoli Gu, Yuhan Zhou, Jingping Qu, Baomin Wang|2026|Chem.Commun.|62|4545|doi:10.1039/d5cc06578j
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.cc2mcnxl
title: CCDC 2424290: Experimental Crystal Structure Determination

description: Related Article: Mahendiran Dharmasivam, Sadia Faiz, Busra Kaya, Tharushi P. Wijesinghe, Mediha Suleymanoglu, Mahan Gholam Azad, Vera Richardson, Ameer Fawad Zahoor, Danuta Kalinowski, William Lewis, Paul V. Bernhardt, Rukhsana Anjum, Des R. Richardson|2026|Chemical Science|||doi:10.1039/d5sc06084b
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.cc2mcq5x
title: CCDC 2424329: Experimental Crystal Structure Determination

description: Related Article: Sangita Mondal, T. Kedara Shivasharma, Sujit Das, Mayur Thosare, Christel Livia Mascarenhas, Babasaheb R. Sankapal, Kartik Chandra Mondal|2026|J.Mater.Chem.A|||doi:10.1039/d5ta05686a
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.cc2mh1x3
title: CCDC 2427545: Experimental Crystal Structure Determination

description: Related Article: Sangita Mondal, T. Kedara Shivasharma, Sujit Das, Mayur Thosare, Christel Livia Mascarenhas, Babasaheb R. Sankapal, Kartik Chandra Mondal|2026|J.Mater.Chem.A|||doi:10.1039/d5ta05686a
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.cc2mjv12
title: CCDC 2429254: Experimental Crystal Structure Determination

description: Related Article: Mengqi Wang, Zhonghui Wu, Xiaoming Jie, Xiaofeng Zhang, Yaping Shang, Weiping Su|2026|Angew.Chem.,Int.Ed.|65|e24475|doi:10.1002/anie.202524475
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.cc2n2x7x
title: CCDC 2445659: Experimental Crystal Structure Determination

description: Related Article: Huiqin Shan, Hai Wu, Kang Shen, Bingrui Wu, Fei Hou, Sani Wang, Jing Zhu, Zhengong Meng, Zhongfu An|2025|Inorg.Chem.|||doi:10.1021/acs.inorgchem.5c03560
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.462ph8
title: Occurrence Download

description: A dataset containing 420045 species occurrences available in GBIF matching the query:
{
 "DatasetKey" : [
 "is The fossil collection (F) of the Muséum national d'Histoire naturelle (MNHN - Paris)"
 ]
}

 The dataset includes 420045 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0000007-260225131425191/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.cc2n2x8y
title: CCDC 2445660: Experimental Crystal Structure Determination

description: Related Article: Huiqin Shan, Hai Wu, Kang Shen, Bingrui Wu, Fei Hou, Sani Wang, Jing Zhu, Zhengong Meng, Zhongfu An|2025|Inorg.Chem.|||doi:10.1021/acs.inorgchem.5c03560
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.cc2n2x9z
title: CCDC 2445661: Experimental Crystal Structure Determination

description: Related Article: Huiqin Shan, Hai Wu, Kang Shen, Bingrui Wu, Fei Hou, Sani Wang, Jing Zhu, Zhengong Meng, Zhongfu An|2025|Inorg.Chem.|||doi:10.1021/acs.inorgchem.5c03560
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.cc2nccw9
title: CCDC 2453801: Experimental Crystal Structure Determination

description: Related Article: Wenhui Yang, Wenwen Zhao, Jianbiao Liu, Shu Chen, Licai Ma, Mengying Jia, Xianxiu Xu|2026|ACS Catalysis|||doi:10.1021/acscatal.5c08631
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.cc2nccxb
title: CCDC 2453802: Experimental Crystal Structure Determination

description: Related Article: Wenhui Yang, Wenwen Zhao, Jianbiao Liu, Shu Chen, Licai Ma, Mengying Jia, Xianxiu Xu|2026|ACS Catalysis|||doi:10.1021/acscatal.5c08631
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.cc2ncrd6
title: CCDC 2454158: Experimental Crystal Structure Determination

description: Related Article: Wenhui Yang, Wenwen Zhao, Jianbiao Liu, Shu Chen, Licai Ma, Mengying Jia, Xianxiu Xu|2026|ACS Catalysis|||doi:10.1021/acscatal.5c08631
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.cc2np7m7
title: CCDC 2463279: Experimental Crystal Structure Determination

description: Related Article: Jocelyn Pradegan, Aurélien Crochet, Katharina M. Fromm|2026|Cryst.Growth Des.|||doi:10.1021/acs.cgd.5c01024
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.cc2np7n8
title: CCDC 2463280: Experimental Crystal Structure Determination

description: Related Article: Jocelyn Pradegan, Aurélien Crochet, Katharina M. Fromm|2026|Cryst.Growth Des.|||doi:10.1021/acs.cgd.5c01024
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.cc2np7p9
title: CCDC 2463281: Experimental Crystal Structure Determination

description: Related Article: Jocelyn Pradegan, Aurélien Crochet, Katharina M. Fromm|2026|Cryst.Growth Des.|||doi:10.1021/acs.cgd.5c01024
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.hdp7ap
title: Occurrence Download

description: A dataset containing 3391 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "OccurrenceStatus is Present",
 {
 "not" : {
 "BasisOfRecord" : [
 "is one of (Fossil, Living Specimen)"
 ]
 }
 },
 "TaxonKey is Hypolaena fastigiata",
 "Year is less than or equal to 2000",
 "Year is greater than or equal to 1970",
 {
 "or" : [
 {
 "not" : {
 "EstablishmentMeans" : [
 "is one of (MANAGED, INTRODUCED)"
 ]
 }
 },
 "EstablishmentMeans is null"
 ]
 },
 {
 "or" : [
 "CoordinateUncertaintyInMeters is less than 1000",
 "CoordinateUncertaintyInMeters is null"
 ]
 }
 ]
}

 The dataset includes 3391 records from 25 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0000013-260225131425191/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.cc2np7qb
title: CCDC 2463282: Experimental Crystal Structure Determination

description: Related Article: Jocelyn Pradegan, Aurélien Crochet, Katharina M. Fromm|2026|Cryst.Growth Des.|||doi:10.1021/acs.cgd.5c01024
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.cc2np7rc
title: CCDC 2463283: Experimental Crystal Structure Determination

description: Related Article: Jocelyn Pradegan, Aurélien Crochet, Katharina M. Fromm|2026|Cryst.Growth Des.|||doi:10.1021/acs.cgd.5c01024
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.sa9zab
title: Occurrence Download

description: A dataset containing 1385 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Anemia ferruginea Kunth",
 "BasisOfRecord is Specimen"
 ]
}

 The dataset includes 1385 records from 101 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0108894-230224095556074/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.cc2np7sd
title: CCDC 2463284: Experimental Crystal Structure Determination

description: Related Article: Jocelyn Pradegan, Aurélien Crochet, Katharina M. Fromm|2026|Cryst.Growth Des.|||doi:10.1021/acs.cgd.5c01024
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.cc2np7tf
title: CCDC 2463285: Experimental Crystal Structure Determination

description: Related Article: Jocelyn Pradegan, Aurélien Crochet, Katharina M. Fromm|2026|Cryst.Growth Des.|||doi:10.1021/acs.cgd.5c01024
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.k9mbkq
title: Occurrence Download

description: A dataset containing 865 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Anemia mexicana Klotzsch",
 "BasisOfRecord is Specimen"
 ]
}

 The dataset includes 865 records from 69 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0108906-230224095556074/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.