cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.17629321
title: MSR-ACC/TAE25: 73k coupled cluster atomization energies for broad chemical space

description: Microsoft Research Accurate Chemistry Collection (MSR-ACC) presents MSR-ACC/TAE25, a dataset of 73k accurate total atomization energies (TAE) of small molecules with up to 5 non-hydrogen elements up to argon, excluding only rare-gas atoms. The atomization energies are computed at the CCSD(T)/CBS level with the W1-F12 protocol. All details including the description of the files can be found in the accompanying publication available on Arxiv. As a preview, each JSON file encodes one molecule in the QCSchema:

{
 "symbols": list[str],
 "geometry": list[float],
 "name": str,
 "molecular_charge": float,
 "molecular_multiplicity": int,
 "atomic_numbers": list[int],
 "extras": {
  "atom-count:all": int,
  "atom-count:non-h": int,
  "graph:all": list[list[int]],
  "graph:non-h": list[list[int]],
  "singlet-triplet-gap-s0-t1@*": float,
  "tae:frac[(T)]@*": float,
  "tae@*": float,
  "tae[*]@*": float
 }
}

After downloading and extracting, the data can be loaded for example with

from pathlib import Path
import qcelemental as qcel

msracc_tae25 = [
    qcel.models.Molecule.from_file(path) for path in Path("msr-acc/tae25").glob("*.json")
]
DOI: 10.15468/dl.uhm74a
title: Occurrence Download

description: A dataset containing 2820 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is one of (Allium schoenoprasum, Allium schoenoprasum)",
 "Year is greater than or equal to 1900",
 "Geometry POLYGON ((8.643 46.99, 14.1 46.92, 14.43 50.75, 8.534 50.83, 8.643 46.99))",
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "OccurrenceStatus is Present",
 "BasisOfRecord is one of (Observation, Human Observation, Machine Observation, Material sample)"
 ]
}

 The dataset includes 2820 records from 22 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0011391-260129131611470/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.9fvg8a
title: Occurrence Download

description: A dataset containing 841 species occurrences available in GBIF matching the query:
{
 "and" : [
 "BasisOfRecord is Human Observation",
 "Continent is Europe",
 "Country is Netherlands",
 "OccurrenceStatus is Present",
 "TaxonKey is Canis lupus",
 "Year 2013-2026"
 ]
}

 The dataset includes 841 records from 3 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0011392-260129131611470/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25824/redu/3teqds
title: Mechanical properties of heat-set gels structured by lupin protein isolate

description: These data refer to the master’s thesis entitled Heat-set and cold-set gels structured by lupin protein isolate, defended on March 10, 2025, at the School of Food Engineering, University of Campinas. The study evaluated the mechanical properties and in vitro protein digestibility of heat-set gels prepared at four different protein concentrations, structured with lupin protein isolate. The presented data correspond to frequency sweeps performed on the gel samples using a TA Instruments rheometer.
DOI: 10.15468/dl.x9c5at
title: Occurrence Download

description: A dataset containing 1616 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Duma florulenta",
 "HasCoordinate is true",
 "BasisOfRecord is one of (Specimen)"
 ]
}

 The dataset includes 1616 records from 35 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0011394-260129131611470/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5281/zenodo.18471138
title: Spatial mapping of Ethiopian cutaneous leishmaniasis lesions reveals distinct tissue level immune programs

description: Data Files Description

Study Overview

Ethiopian cutaneous leishmaniasis shows heterogeneous clinical presentations. This study used 10x Visium spatial transcriptomics on paired lesional and non-lesional skin biopsies from five patients to characterize local immune responses. Using reference-free deconvolution and morphology-guided analyses, we identified five spatially distinct immunopathological response patterns that can co-exist within individual lesions.

Raw sequencing data: NCBI GEO accession GSE317987 Analysis code: https://github.com/NidhiSDey/SpatialCL.git

 

Files Uploaded

Seurat Objects (.rds)

1. integrated_seurat_obj.Rds- Initial integrated Seurat object containing all 10 samples (5 patients × 2 conditions)- Quality-filtered, normalized, and integrated SCTtransform- Does not include LDA topic deconvolution- Used as input for downstream LDA analyses

2. integrated_seurat_obj_23_LDA_topics_added.rds- Integrated object with 23 LDA topics added to metadata- Contains all 10 samples (lesional + non-lesional)- Used for lesional vs non-lesional comparisons- Includes topic proportions and dominant topic assignments

3. lesion_only_integrated_obj_35_LDA_topics_added.rds- Lesion-only samples (5 patients) with 35 LDA topics- Primary analysis object for patient-specific studies- Contains spatial domain annotations and cell type assignments- Used for all patient-specific analyses and main figures

LDA Models (.rds/.Rdata)

4. combined_lda_model_k8_60.Rdata- LDA topic models for all samples (lesional + non-lesional)- Models computed for k = 8, 10, 12, ..., 60 topics- Used to select optimal topic number (k=23) for combined analysis

5. lesion_LDA_model_k_26_52.rds- LDA topic models for lesion-only samples- Models computed for k = 26, 28, 30, ..., 52 topics- Used to select optimal topic number (k=35) for lesion analysis
DOI: 10.5281/zenodo.18471139
title: Spatial mapping of Ethiopian cutaneous leishmaniasis lesions reveals distinct tissue level immune programs

description: Data Files Description

Study Overview

Ethiopian cutaneous leishmaniasis shows heterogeneous clinical presentations. This study used 10x Visium spatial transcriptomics on paired lesional and non-lesional skin biopsies from five patients to characterize local immune responses. Using reference-free deconvolution and morphology-guided analyses, we identified five spatially distinct immunopathological response patterns that can co-exist within individual lesions.

Raw sequencing data: NCBI GEO accession GSE317987 Analysis code: https://github.com/NidhiSDey/SpatialCL.git

 

Files Uploaded

Seurat Objects (.rds)

1. integrated_seurat_obj.Rds- Initial integrated Seurat object containing all 10 samples (5 patients × 2 conditions)- Quality-filtered, normalized, and integrated SCTtransform- Does not include LDA topic deconvolution- Used as input for downstream LDA analyses

2. integrated_seurat_obj_23_LDA_topics_added.rds- Integrated object with 23 LDA topics added to metadata- Contains all 10 samples (lesional + non-lesional)- Used for lesional vs non-lesional comparisons- Includes topic proportions and dominant topic assignments

3. lesion_only_integrated_obj_35_LDA_topics_added.rds- Lesion-only samples (5 patients) with 35 LDA topics- Primary analysis object for patient-specific studies- Contains spatial domain annotations and cell type assignments- Used for all patient-specific analyses and main figures

LDA Models (.rds/.Rdata)

4. combined_lda_model_k8_60.Rdata- LDA topic models for all samples (lesional + non-lesional)- Models computed for k = 8, 10, 12, ..., 60 topics- Used to select optimal topic number (k=23) for combined analysis

5. lesion_LDA_model_k_26_52.rds- LDA topic models for lesion-only samples- Models computed for k = 26, 28, 30, ..., 52 topics- Used to select optimal topic number (k=35) for lesion analysis
DOI: 10.5281/zenodo.18480628
title: ТАЪЛИМ СОҲАСИДАГИ ЎЗБЕКИСТОН-ХИТОЙ МУНОСАБАТЛАРИНИНГ ҲУҚУҚИЙ АСОСЛАРИ

description: Мақолада таълим соҳасидаги Ўзбекистон–Хитой муносабатларининг ҳуқуқий-институционал асослари таҳлил қилинган. Икки давлат ўртасидаги таълим ҳамкорлигини тартибга солувчи давлатлараро битимлар, келишувлар ва институционал механизмлар мазмуни очиб берилган. Хусусан, Ўзбекистон–Хитой ҳукуматлараро ҳамкорлик қўмитаси, унинг маданий-гуманитар подқўмитаси, шунингдек, 2024 йилда Пекинда ўтказилган Ўзбекистон-Хитой таълим форуми ва Пекин декларациясининг аҳамияти ёритилган. Мақолада Конфуций институтлари, олий таълим муассасалари ўртасидаги ҳамкорлик, академик алмашув дастурлари ва қўшма таълим лойиҳаларининг роли ҳам кўриб чиқилган. Хулосада таълим соҳасидаги ҳуқуқий ва институционал асослар икки давлат ўртасидаги узоқ муддатли ҳамкорликни таъминловчи муҳим омил экани илмий жиҳатдан асослаб берилган.
DOI: 10.5281/zenodo.18480629
title: ТАЪЛИМ СОҲАСИДАГИ ЎЗБЕКИСТОН-ХИТОЙ МУНОСАБАТЛАРИНИНГ ҲУҚУҚИЙ АСОСЛАРИ

description: Мақолада таълим соҳасидаги Ўзбекистон–Хитой муносабатларининг ҳуқуқий-институционал асослари таҳлил қилинган. Икки давлат ўртасидаги таълим ҳамкорлигини тартибга солувчи давлатлараро битимлар, келишувлар ва институционал механизмлар мазмуни очиб берилган. Хусусан, Ўзбекистон–Хитой ҳукуматлараро ҳамкорлик қўмитаси, унинг маданий-гуманитар подқўмитаси, шунингдек, 2024 йилда Пекинда ўтказилган Ўзбекистон-Хитой таълим форуми ва Пекин декларациясининг аҳамияти ёритилган. Мақолада Конфуций институтлари, олий таълим муассасалари ўртасидаги ҳамкорлик, академик алмашув дастурлари ва қўшма таълим лойиҳаларининг роли ҳам кўриб чиқилган. Хулосада таълим соҳасидаги ҳуқуқий ва институционал асослар икки давлат ўртасидаги узоқ муддатли ҳамкорликни таъминловчи муҳим омил экани илмий жиҳатдан асослаб берилган.
DOI: 10.15468/dl.t3jav8
title: Occurrence Download

description: A dataset containing 13926 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Geometry POLYGON ((-70.788256 -33.306235, -70.759801 -33.249886, -70.832354 -33.249886, -70.860838 -33.306235, -70.788256 -33.306235))",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Year is greater than or equal to 2015",
 "Year is less than or equal to 2026"
 ]
}

 The dataset includes 13926 records from 8 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0011393-260129131611470/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5281/zenodo.18480645
title: https://www.academia.edu/164422761/ANALISIS_KEBUTUHAN_SARANA_DAN_PRASARANA_WILAYAH_KABUPATEN_MAGELANG
DOI: 10.5281/zenodo.18480646
title: https://www.academia.edu/164422761/ANALISIS_KEBUTUHAN_SARANA_DAN_PRASARANA_WILAYAH_KABUPATEN_MAGELANG
DOI: 10.57745/j7gqdw
title: Analysis of solid matters and particle-bound pesticides as part of the PULSE project

description: This dataset was collected at the ZABR's Ardières-Morcille site-atelier (Beaujolais, France) at 3 measurement sites at 3 different scales: plot, sub-catchment and catchment. For more information on data collection and analysis, please refer to the associated datapaper. The dataset consists of the sediment budget from the sediment trap installed on the plot and samples analysis for grain size, major elements analysis of solid matters, and particle-bound pesticides.
DOI: 10.5281/zenodo.18429573
title: ARG-sniper: Reference database for different tools

description: Antimicrobial, biocide, and metal resistance gene sequences were collected from seven public databases: AMRFinderPlus, ARG-ANNOT, BacMet, CARD, MegaRes, ResFinder, and ResFinderFG. From an initial set of 31,817 sequences, genes lacking canonical start and/or stop codons were removed, yielding 29,341 sequences. These were subsequently deduplicated and clustered at 90% sequence identity and coverage thresholds, then refined using GeneAssimilator to generate a unified, non-redundant resistance gene collection. Database-specific input formats were reconstructed from this unified collection for five AMR detection tools: ARGprofiler, ARIBA, GROOT, KARGA, and SRST2.
DOI: 10.5281/zenodo.18429574
title: ARG-sniper: Reference database for different tools

description: Antimicrobial, biocide, and metal resistance gene sequences were collected from seven public databases: AMRFinderPlus, ARG-ANNOT, BacMet, CARD, MegaRes, ResFinder, and ResFinderFG. From an initial set of 31,817 sequences, genes lacking canonical start and/or stop codons were removed, yielding 29,341 sequences. These were subsequently deduplicated and clustered at 90% sequence identity and coverage thresholds, then refined using GeneAssimilator to generate a unified, non-redundant resistance gene collection. Database-specific input formats were reconstructed from this unified collection for five AMR detection tools: ARGprofiler, ARIBA, GROOT, KARGA, and SRST2.
DOI: 10.5281/zenodo.18480655
title: ТАЪЛИМ СОҲАСИДАГИ ЎЗБЕКИСТОН-ХИТОЙ МУНОСАБАТЛАРИГА ТАЪСИР КЎРСАТУВЧИ ОМИЛЛАР

description: Мақолада таълим соҳасидаги Ўзбекистон-Хитой муносабатларига таъсир қилувчи омиллар таҳлил қилинган. Ижобий омиллар сифатида икки давлат раҳбарларининг сиёсий иродаси, «Бир камар, бир йўл» ташаббуси, Хитойнинг юмшоқ куч сиёсати, Ўзбекистон таълим ислоҳотлари, иқтисодий алоқаларнинг кучайиши, таълим сифати, грант дастурлари, тарихий алоқалар ва ШҲТ ҳамкорлиги кўрсатилган. Салбий омилларга тил тўсиғи, маданий фарқлар, географик масофа, диплом тан олиш, ахборот етишмовчилиги, молиявий қийинчиликлар, пандемия оқибатлари, геосиёсий таранглик ва бошқалар киради. Хулосада ушбу омилларни таҳлил қилиш орқали таълим ҳамкорлигининг истиқболларини яхшилаш таклиф этилган.
DOI: 10.5281/zenodo.18480656
title: ТАЪЛИМ СОҲАСИДАГИ ЎЗБЕКИСТОН-ХИТОЙ МУНОСАБАТЛАРИГА ТАЪСИР КЎРСАТУВЧИ ОМИЛЛАР

description: Мақолада таълим соҳасидаги Ўзбекистон-Хитой муносабатларига таъсир қилувчи омиллар таҳлил қилинган. Ижобий омиллар сифатида икки давлат раҳбарларининг сиёсий иродаси, «Бир камар, бир йўл» ташаббуси, Хитойнинг юмшоқ куч сиёсати, Ўзбекистон таълим ислоҳотлари, иқтисодий алоқаларнинг кучайиши, таълим сифати, грант дастурлари, тарихий алоқалар ва ШҲТ ҳамкорлиги кўрсатилган. Салбий омилларга тил тўсиғи, маданий фарқлар, географик масофа, диплом тан олиш, ахборот етишмовчилиги, молиявий қийинчиликлар, пандемия оқибатлари, геосиёсий таранглик ва бошқалар киради. Хулосада ушбу омилларни таҳлил қилиш орқали таълим ҳамкорлигининг истиқболларини яхшилаш таклиф этилган.
DOI: 10.5281/zenodo.17611955
title: ARG-sniper: Unified Databases

description: Collection and processing of antimicrobial, biocide, and metal resistance genes from seven public databases (AMRFinderPlus, ARG-ANNOT, BacMet, CARD, MegaRes, ResFinder, and ResFinderFG). Initial sequences (n=31,817) were filtered to remove genes lacking start/stop codons (n=29,341 retained), deduplicated, clustered at 90% identity/coverage, and refined using GeneAssimilator to generate a unified resistance gene collection.
DOI: 10.5281/zenodo.17611954
title: ARG-sniper: Unified Databases

description: Collection and processing of antimicrobial, biocide, and metal resistance genes from seven public databases (AMRFinderPlus, ARG-ANNOT, BacMet, CARD, MegaRes, ResFinder, and ResFinderFG). Initial sequences (n=31,817) were filtered to remove genes lacking start/stop codons (n=29,341 retained), deduplicated, clustered at 90% identity/coverage, and refined using GeneAssimilator to generate a unified resistance gene collection.
DOI: 10.5517/ccdc.csd.cc2ckqrf
title: CCDC 2191785: Experimental Crystal Structure Determination

description: Related Article: Chikako Endo, Yurika Inoue, Toshifumi Maruyama, Mao Minoura, Toshiaki Murai|2023|Synthesis|55|934|doi:10.1055/a-1948-3003
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.cc2g4y4q
title: CCDC 2268863: Experimental Crystal Structure Determination

description: Related Article: William Harrison, M John Plater|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: 10.5517/ccdc.csd.cc2fq6zc
title: CCDC 2255683: Experimental Crystal Structure Determination

description: Related Article: William Harrison, Rama Devi|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: 10.5517/ccdc.csd.cc2hn70f
title: CCDC 2313344: Experimental Crystal Structure Determination

description: Related Article: Javier Álvarez-Conde, M. Paz Fernández-Liencres, Sonia B. Jiménez-Pulido, Cristina Martín, Amparo Navarro, Juan Cabanillas-González, Eva M. García-Frutos|2025|Adv.Funct.Mater.|35|2402259|doi:10.1002/adfm.202402859
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.cc2hn72h
title: CCDC 2313346: Experimental Crystal Structure Determination

description: Related Article: Javier Álvarez-Conde, M. Paz Fernández-Liencres, Sonia B. Jiménez-Pulido, Cristina Martín, Amparo Navarro, Juan Cabanillas-González, Eva M. García-Frutos|2025|Adv.Funct.Mater.|35|2402259|doi:10.1002/adfm.202402859
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.cc2hn73j
title: CCDC 2313347: Experimental Crystal Structure Determination

description: Related Article: Javier Álvarez-Conde, M. Paz Fernández-Liencres, Sonia B. Jiménez-Pulido, Cristina Martín, Amparo Navarro, Juan Cabanillas-González, Eva M. García-Frutos|2025|Adv.Funct.Mater.|35|2402259|doi:10.1002/adfm.202402859
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.cc2hn74k
title: CCDC 2313348: Experimental Crystal Structure Determination

description: Related Article: Javier Álvarez-Conde, M. Paz Fernández-Liencres, Sonia B. Jiménez-Pulido, Cristina Martín, Amparo Navarro, Juan Cabanillas-González, Eva M. García-Frutos|2025|Adv.Funct.Mater.|35|2402259|doi:10.1002/adfm.202402859
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.cc2jlm81
title: CCDC 2341593: Experimental Crystal Structure Determination

description: Related Article: Hyehwang Kim, Dipendu Mandal, Joshua Kye Jin Ng, Zheng-Wang Qu, Stefan Grimme, Douglas W. Stephan|2024|Chem.-Eur.J.|30|e202401776|doi:10.1002/chem.202401776
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.cc2jlm92
title: CCDC 2341594: Experimental Crystal Structure Determination

description: Related Article: Hyehwang Kim, Dipendu Mandal, Joshua Kye Jin Ng, Zheng-Wang Qu, Stefan Grimme, Douglas W. Stephan|2024|Chem.-Eur.J.|30|e202401776|doi:10.1002/chem.202401776
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.cc2jlmb3
title: CCDC 2341595: Experimental Crystal Structure Determination

description: Related Article: Hyehwang Kim, Dipendu Mandal, Joshua Kye Jin Ng, Zheng-Wang Qu, Stefan Grimme, Douglas W. Stephan|2024|Chem.-Eur.J.|30|e202401776|doi:10.1002/chem.202401776
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.cc2k0b53
title: CCDC 2353804: Experimental Crystal Structure Determination

description: Related Article: zhangguan|2025|CSD Communication|||
description: Related Article: Guan Zhang, Junyi Jia, Xuzhao Du, Bofan Feng, Kai Yang, Peiyuan Yu, Qiuling Song|2025|Nat.Commun.|16|9955|doi:10.1038/s41467-025-64905-x
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.cc2l0wp6
title: CCDC 2384138: Experimental Crystal Structure Determination

description: Related Article: Zihan Fang, Xijiao Mu, Guo-Bin Xiao, Jing Cao|2025|Angew.Chem.,Int.Ed.|64|e202418834|doi:10.1002/anie.202418834
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.cc2n01yp
title: CCDC 2442922: Experimental Crystal Structure Determination

description: Related Article: Shengyu Zhong|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.