cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc1pt9ng
title: CCDC 1573456: Experimental Crystal Structure Determination

description: Related Article: Ivan Salitros, Lukáš Pogány, Barbora Brachňaková, Jan Moncol, ,Jan Pavlik, Ivan Nemec, Zdeněk Trávniček, Milan Mazúr, Lukáš Bučinský, Ľubomír Suchánek|2017|Chem.-Eur.J.|24|5191|doi:10.1002/chem.201704546
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.cc1pt9ph
title: CCDC 1573457: Experimental Crystal Structure Determination

description: Related Article: Ivan Salitros, Lukáš Pogány, Barbora Brachňaková, Jan Moncol, ,Jan Pavlik, Ivan Nemec, Zdeněk Trávniček, Milan Mazúr, Lukáš Bučinský, Ľubomír Suchánek|2017|Chem.-Eur.J.|24|5191|doi:10.1002/chem.201704546
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.cc1pt9qj
title: CCDC 1573458: Experimental Crystal Structure Determination

description: Related Article: Tao Guo, Bin-Hua Yuan, Wen-Jie Liu|2018|Org.Biomol.Chem.|16|57|doi:10.1039/C7OB02891A
description: Related Article: Tao Guo|2017|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.cc1pt9rk
title: CCDC 1573459: Experimental Crystal Structure Determination

description: Related Article: Tao Guo, Bin-Hua Yuan, Wen-Jie Liu|2018|Org.Biomol.Chem.|16|57|doi:10.1039/C7OB02891A
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.cc1pt84x
title: CCDC 1573409: Experimental Crystal Structure Determination

description: Related Article: Bojidarka Ivanova, Michael Spiteller|2018|Inorg.Chim.Acta|471|219|doi:10.1016/j.ica.2017.10.022
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.cc1pt9yr
title: CCDC 1573465: Experimental Crystal Structure Determination

description: Related Article: Meng-Yao Sun,  Di-Ming Chen,  Cong Li-Gao|2018|J.Cluster Sci.|29|593|doi:10.1007/s10876-018-1372-8
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.cc13pwym
title: CCDC 1033941: Experimental Crystal Structure Determination

description: Related Article: Anastasia N. Georgopoulou, Karrar Al-Ameed, Athanassios K. Boudalis, Dimitrios F. Anagnostopoulos, Vassilis Psycharis, John E. McGrady, Yiannis Sanakis, Catherine P. Raptopoulou|2017|Dalton Trans.|46|12835|doi:10.1039/C7DT02930F
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.cc1pt9zs
title: CCDC 1573466: Experimental Crystal Structure Determination

description: Related Article: Meng-Yao Sun,  Di-Ming Chen,  Cong Li-Gao|2018|J.Cluster Sci.|29|593|doi:10.1007/s10876-018-1372-8
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.cc13pwzn
title: CCDC 1033942: Experimental Crystal Structure Determination

description: Related Article: Anastasia N. Georgopoulou, Karrar Al-Ameed, Athanassios K. Boudalis, Dimitrios F. Anagnostopoulos, Vassilis Psycharis, John E. McGrady, Yiannis Sanakis, Catherine P. Raptopoulou|2017|Dalton Trans.|46|12835|doi:10.1039/C7DT02930F
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.cc13px0q
title: CCDC 1033943: Experimental Crystal Structure Determination

description: Related Article: Anastasia N. Georgopoulou, Karrar Al-Ameed, Athanassios K. Boudalis, Dimitrios F. Anagnostopoulos, Vassilis Psycharis, John E. McGrady, Yiannis Sanakis, Catherine P. Raptopoulou|2017|Dalton Trans.|46|12835|doi:10.1039/C7DT02930F
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.sbb6nn
title: Occurrence Download

description: A dataset containing 1072 species occurrences available in GBIF matching the query:
{
 "and" : [
 "BasisOfRecord is one of (Machine Observation, Human Observation, Material sample, Occurrence evidence)",
 "Geometry POLYGON((-110.99009 32.70782,-110.95899 32.18734,-110.51584 32.37179,-110.61576 32.66954,-110.99009 32.70782))",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "TaxonKey is Mammalia",
 "Year 1000-2020"
 ]
}

 The dataset includes 1072 records from 8 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055333-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.rmby3x
title: Occurrence Download

description: A dataset containing 4922 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Harmonia axyridis",
 "HasCoordinate is true",
 "Country is Italy"
 ]
}

 The dataset includes 4922 records from 10 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055334-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.q23zdy
title: Occurrence Download

description: A dataset containing 4126 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Harmonia axyridis",
 "HasCoordinate is true",
 "Country is Poland"
 ]
}

 The dataset includes 4126 records from 10 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055335-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5439/1366509
title: gndirt

description: This datastream stores upwelling IRT measurements
DOI: 10.15468/dl.4vz6yk
title: Occurrence Download

description: A dataset containing 6002 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Harmonia axyridis",
 "HasCoordinate is true",
 "Country is Sweden"
 ]
}

 The dataset includes 6002 records from 7 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055336-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.d7njhp
title: Occurrence Download

description: A dataset containing 1602 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is Spain",
 "Geometry POLYGON((-26.06906 30.47918,34.06906 30.47918,34.06906 54.52082,-26.06906 54.52082,-26.06906 30.47918))",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "OccurrenceStatus is Present",
 "TaxonKey is Festuca elegans"
 ]
}

 The dataset includes 1602 records from 33 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055338-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5439/1773175
title: Multi-Filter Radiometer (MFR) with 7 Narrowband Channels: upwelling irradiances at 10-meter height

description: Multi-Filter Radiometer (MFR) with 7 Narrowband Channels: upwelling irradiances at 10-meter height
DOI: 10.13012/b2idb-3309028_v1
title: Data for Application of Time-Domain 1H NMR for Investigating Dynamics of Vegetative Lipids in Bioenergy Crops at Different Developmental Stages

description: Sweet sorghum is typically cultivated for the food and fodder market. Recently, sweet sorghum varieties are being metabolically transitioned to enhance energy density by accumulating oil droplets in their vegetative tissues for bioenergy applications. Owing to the high biomass yield of sorghum, the transgenic lines can compete with oil-seed crops for biodiesel yield per unit area. In the initial phase of transgenic development, a high-throughput phenotyping method can bridge the gap between the production pipeline and analysis to improve the efficiency of the process. To meet the requirement, the present study extends the application of time-domain 1H-NMR spectroscopy for rapid quantification and characterization of the total in-situ lipids of sweet sorghum ‘ramada’ to lay the groundwork for analyzing the upcoming large quantity of transgenic samples. NMR technology has been successfully established for analyzing lipid contents of vegetative tissues of non-transgenic variety. The multiexponential analysis of spin-lattice (T1) relaxation spectra obtained from TD-NMR aided the investigation of the dynamics of the free and bound lipid fraction with plant development. The total lipid concentration of bagasse and leaves of non-transgenic sweet sorghum remained unchanged throughout the plant development. Leaves displayed a higher percentage of bound lipids as compared to bagasse. A significant variation in the lipid concentration of juice was observed at the different growth stages with a maximum lipid accumulation of 1.21 ± 0.04% w/w at the boot stage that decreased with further maturity of the plant.
DOI: 10.5281/zenodo.17436943
title: Data, Model Configurations, and Scripts Supporting "Towards a Comprehensive Decision Support System for Agroforestry Systems"

description: capsis  -p script safe.pgms.ScriptVerif C:/Projects/capsis4/data/safe/simSettings/ERL/agroforestry.sim

capsis  –p script safe.pgms.ScriptGen C:/Projects/capsis4/data/safe/simSettings/ERL/agroforestry.sim

 

This dataset provides all input data, configuration files, and processing scripts supporting the study “Towards a Comprehensive Decision Support System for Agroforestry Systems.” The materials include sensor-based microclimate measurements, Hi-sAFe simulation configurations, and R scripts used for preprocessing, gap-filling, and hybrid Hi-sAFe–ML integration. The repository ensures full transparency and reproducibility of the analyzes presented in the manuscript. 

LSTM-based model was developed to predict microclimate conditions using only macroclimate data , specifically tailored for agroforestry environments . It enables microclimate simulation where direct sensor measurements are unavailable and serves as a critical component in the hybrid Hi-sAFe + ML framework presented in our Environmental Research Letters (ERL) publication (git@github.com:DrAhmedKheir/Developping-Microclimate-Model.git).
DOI: 10.15468/dl.ee4bg7
title: Occurrence Download

description: A dataset listing the 3214 species recorded in GBIF matching the query:
{
 "and" : [
 "Geometry POLYGON((-76.0253 1.0412,-75.86077 0.88922,-75.21393 0.66566,-75.24031 1.01105,-75.37847 1.11656,-75.63594 1.26099,-75.89459 1.24017,-76.0541 1.23766,-76.23873 1.17109,-76.48239 1.13341,-76.54143 1.04298,-76.40201 0.91613,-76.09726 0.99329,-76.05079 1.02343,-76.0253 1.0412))",
 "OccurrenceStatus is Present"
 ]
}

 The dataset's 3214 records were derived from 127 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0055332-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.yv844k
title: Occurrence Download

description: A dataset containing 13554 species occurrences available in GBIF matching the query:
{
 "and" : [
 "DatasetKey is Spatially explicit database of tree related microhabitats (TreMs)",
 "TaxonKey is Fagus sylvatica L."
 ]
}

 The dataset includes 13554 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0207111-230224095556074/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/pcra-c14-181364
title: Dukhovnyye istochniki = Spiritual resources, no. 24 (2010 Winter)

description: [description english/roman)] Dukhovnyye istochniki, no. 24 (2010 zima) = Spiritual resources, no. 24 (2010 Winter). Supplement to the "Mediator", the publication of the Union of Christians of Evangelical Faith - Pentecostals in Russia.
DOI: 10.15468/dl.3d5rnh
title: Occurrence Download

description: A dataset containing 150 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Arborimus pomo Johnson & George, 1991",
 "HasCoordinate is True",
 "Country is United States of America",
 "Year is greater than or equal to 1960",
 "Year is less than or equal to 2020",
 "Month is greater than or equal to January",
 "Month is less than or equal to December",
 "HasGeospatialIssue is False",
 "DecimalLatitude is greater than or equal to 24.5",
 "DecimalLatitude is less than or equal to 49.5",
 "DecimalLongitude is greater than or equal to -125.0",
 "DecimalLongitude is less than or equal to -66.5"
 ]
}

 The dataset includes 150 records from 6 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0117298-210914110416597/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/pcra-c14-181286
title: Dukhovnyye istochniki = Spiritual resources, no. 21 (2008 Fall)

description: [description english/roman)] Dukhovnyye istochniki, no. 21 (2008 osen') = Spiritual resources, no. 21 (2008 Fall). Supplement to the "Mediator", the publication of the Union of Christians of Evangelical Faith - Pentecostals in Russia.
DOI: 10.25549/pcra-c14-181287
title: Dukhovnyye istochniki = Spiritual resources, no. 21 (2008 Fall)

description: [description english/roman)] Dukhovnyye istochniki, no. 21 (2008 osen') = Spiritual resources, no. 21 (2008 Fall). Supplement to the "Mediator", the publication of the Union of Christians of Evangelical Faith - Pentecostals in Russia.
DOI: 10.25549/pcra-c14-183813
title: Istoriya Yevangel'sko-Baptistskogo Dvizhenni v Ukraine = [History of the Evangelical Baptist movement in Ukraine], 1998

description: [description english/roman)] S.I. Golovashchenko, compiler. Istoriya Yevangel'sko-Baptistskogo Dvizhenni v Ukraine: materialy i dokumenty = [History of the Evangelical Baptist movement in Ukraine: materials and documents]. Odessa, Ukraine: Bogomysliye [Thoughts of God], 1998.
DOI: 10.25549/pcra-c14-183783
title: Istoriya Yevangel'sko-Baptistskogo Dvizhenni v Ukraine = [History of the Evangelical Baptist movement in Ukraine], 1998

description: [description english/roman)] S.I. Golovashchenko, compiler. Istoriya Yevangel'sko-Baptistskogo Dvizhenni v Ukraine: materialy i dokumenty = [History of the Evangelical Baptist movement in Ukraine: materials and documents]. Odessa, Ukraine: Bogomysliye [Thoughts of God], 1998.
DOI: 10.15468/dl.zjn5q9
title: Occurrence Download

description: A dataset listing the 266677 species recorded in GBIF matching the query:
{
 "TaxonKey" : [
 "is Chordata"
 ]
}

 The dataset's 266677 records were derived from 22908 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0011419-231002084531237/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.qet4vj
title: Occurrence Download

description: A dataset containing 918 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is one of (Symphyotrichum ×versicolor (Willd.) G.L.Nesom)",
 "BasisOfRecord is one of (Specimen, Human Observation, Observation, Living Specimen, Machine Observation, Literature Occurrence)",
 "Geometry POLYGON((-180 -90,180 -90,180 90,-180 90,-180 -90))",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Year is greater than or equal to 1945"
 ]
}

 The dataset includes 918 records from 58 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0018979-250402121839773/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.bn82yw
title: Occurrence Download

description: A dataset containing 107488 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is one of (Psittaciformes)",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Year is greater than or equal to 1980",
 "OccurrenceStatus is Present",
 {
 "not" : {
 "BasisOfRecord" : [
 "is one of (Fossil, Living Specimen)"
 ]
 }
 },
 "Geometry POLYGON((60 30,90 30,90 60,60 60,60 30))"
 ]
}

 The dataset includes 107488 records from 12 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0059076-250920141307145/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5281/zenodo.17289458
title: Protein Test Set and Receptor Grid Generation Input Files

description: This directory contains protein structure and model files, and receptor grid generation input files.

The files are organized into several subdirectories as follows:

 

- fragment_bound_xray_structures/: contains 33 .pdb files corresponding to experimentally determined

  x-ray protein crystal structures with bound fragments. File names begin with UniProt IDs of corresponding

  proteins (e.g. B9MKT4_frag_bound_protein.pdb)

 

- larger_ligand_bound_xray_structures/: contains 33 .pdb files corresponding to experimentally determined

          x-ray protein crystal structures with bound larger ligands. File names begin with UniProt IDs of corresponding

          proteins (e.g. B9MKT4_larger_ligand_bound_protein.pdb)

 

- AF_models/: contains 33 .pdb files corresponding to AF2-generated protein models downloaded from EMBL-EBI database.

  File names begin with UniProt IDs of corresponding proteins (e.g. B9MKT4_AF.pdb)

 

- AF_ensembles/: contains 33 folders corresponding to each protein in the test set. Each folder contains an ensemble

  of 500 AF2-generated protein models. The models are named with respect to rank (1-500), model (1-5), and seed (0-99)

  of the generated model (e.g. rank_001_model_2_seed_088)

 

- receptor_grid_input_files/: contains 2 folders for_AF_models/ and for_unbound_structures/. Each folder contains

  input files for receptor grid generation when using a probe from FTMap consensus site to define the box center

  for AF models and unbound structures, respectively (these center coordinates are for box configurations 2 and 3).

  The coordinates of the box center are in-line with GRID_CENTER.
DOI: 10.5281/zenodo.17289459
title: Protein Test Set and Receptor Grid Generation Input Files

description: This directory contains protein structure and model files, and receptor grid generation input files.

The files are organized into several subdirectories as follows:

 

- fragment_bound_xray_structures/: contains 33 .pdb files corresponding to experimentally determined

  x-ray protein crystal structures with bound fragments. File names begin with UniProt IDs of corresponding

  proteins (e.g. B9MKT4_frag_bound_protein.pdb)

 

- larger_ligand_bound_xray_structures/: contains 33 .pdb files corresponding to experimentally determined

          x-ray protein crystal structures with bound larger ligands. File names begin with UniProt IDs of corresponding

          proteins (e.g. B9MKT4_larger_ligand_bound_protein.pdb)

 

- AF_models/: contains 33 .pdb files corresponding to AF2-generated protein models downloaded from EMBL-EBI database.

  File names begin with UniProt IDs of corresponding proteins (e.g. B9MKT4_AF.pdb)

 

- AF_ensembles/: contains 33 folders corresponding to each protein in the test set. Each folder contains an ensemble

  of 500 AF2-generated protein models. The models are named with respect to rank (1-500), model (1-5), and seed (0-99)

  of the generated model (e.g. rank_001_model_2_seed_088)

 

- receptor_grid_input_files/: contains 2 folders for_AF_models/ and for_unbound_structures/. Each folder contains

  input files for receptor grid generation when using a probe from FTMap consensus site to define the box center

  for AF models and unbound structures, respectively (these center coordinates are for box configurations 2 and 3).

  The coordinates of the box center are in-line with GRID_CENTER.
DOI: 10.5281/zenodo.17289525
title: Materials for "Bio-inspired buckling joints improve post-collision stability in flapping wings: a structural dynamics perspective"

description: Models, data sets and visualization tools for publication "Bio-inspired buckling joints improve post-collision stability in flapping wings: a structural dynamics perspective"
DOI: 10.5281/zenodo.17289526
title: Materials for "Bio-inspired buckling joints improve post-collision stability in flapping wings: a structural dynamics perspective"

description: Models, data sets and visualization tools for publication "Bio-inspired buckling joints improve post-collision stability in flapping wings: a structural dynamics perspective"
DOI: 10.15468/dl.sh4xqv
title: Occurrence Download

description: A dataset containing 0 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is one of (Austrogomphus angelorum Tillyard, 1913)",
 "BasisOfRecord is one of (Machine Observation, Human Observation, Observation, Literature Occurrence)",
 "HasCoordinate is true"
 ]
}

 The dataset includes 0 records from 0 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0002531-250227182430271/datasets/export for details.