cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.7946850
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Phillip Hogan, https://orcid.org/0000-0002-6546-272X. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
DOI: 10.5281/zenodo.7946851
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Phillip Hogan, https://orcid.org/0000-0002-6546-272X. Claims were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
DOI: 10.5281/zenodo.7959785
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Phillip Hogan, https://orcid.org/0000-0002-6546-272X. Claims were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
DOI: 10.5281/zenodo.8180614
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Phillip Hogan, https://orcid.org/0000-0002-6546-272X. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
DOI: 10.5281/zenodo.14159707
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Benjamin Franklin Dewees Runk, http://www.wikidata.org/entity/Q94259953. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q94259953
DOI: 10.5281/zenodo.14159708
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Benjamin Franklin Dewees Runk, http://www.wikidata.org/entity/Q94259953. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q94259953
DOI: 10.5281/zenodo.14183305
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Benjamin Franklin Dewees Runk, http://www.wikidata.org/entity/Q94259953. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q94259953
DOI: 10.5281/zenodo.14174317
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Beata M. Pokryszko, http://www.wikidata.org/entity/Q21340259. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q21340259
DOI: 10.5281/zenodo.14174318
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Beata M. Pokryszko, http://www.wikidata.org/entity/Q21340259. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q21340259
DOI: 10.5281/zenodo.14183306
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Beata M. Pokryszko, http://www.wikidata.org/entity/Q21340259. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q21340259
DOI: 10.5281/zenodo.14174321
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Władysław Rydzewski, http://www.wikidata.org/entity/Q26769396. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q26769396
DOI: 10.5281/zenodo.14174322
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Władysław Rydzewski, http://www.wikidata.org/entity/Q26769396. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q26769396
DOI: 10.5281/zenodo.14183307
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Władysław Rydzewski, http://www.wikidata.org/entity/Q26769396. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q26769396
DOI: 10.5281/zenodo.14182814
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Grace R. Meeker, http://www.wikidata.org/entity/Q131275456. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q131275456
DOI: 10.5281/zenodo.14182815
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Grace R. Meeker, http://www.wikidata.org/entity/Q131275456. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q131275456
DOI: 10.5281/zenodo.14183309
title: Natural history specimens collected and/or identified and deposited.

description: Natural history specimen data collected and/or identified by Grace R. Meeker, http://www.wikidata.org/entity/Q131275456. Claims or attributions were made on Bionomia, https://bionomia.net using specimen data from the Global Biodiversity Information Facility, https://gbif.org.
description: http://www.wikidata.org/entity/Q131275456
DOI: 10.15468/dl.mrjfjr
title: Occurrence Download

description: A dataset containing 25 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Cambarus smilax Loughman, Simon & Welsh, 2011"
 ]
}

 The dataset includes 25 records from 4 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020618-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5281/zenodo.14183285
title: "Tecnologías Emergentes y Transformación Digital en la Educación Rural Peruana"
DOI: 10.5281/zenodo.14183286
title: "Tecnologías Emergentes y Transformación Digital en la Educación Rural Peruana"
DOI: 10.6084/m9.figshare.16417161
title: Erythropoietin (EPO) gene polymorphisms and diabetic retinopathy: genotype data from a case-control study

description: Genotype data of the rs1617640, rs507392 and rs551238 polymorphisms obtained in a sample of outpatients with type 2 diabetes from Southern Brazil.
<br>
<strong>Supplementary material for: </strong>Sesti LFC, Sbruzzi RC, Polina ER, Soares DS, Crispim D, Canani LH, Santos KG. Association of polymorphisms in the erythropoietin gene with diabetic retinopathy: a case-control study and systematic review with meta-analysis. <em>BMC Ophthalmol</em> <strong>22,</strong> 250 (2022). https://doi.org/10.1186/s12886-022-02467-y
DOI: 10.6084/m9.figshare.16417161.v1
title: Erythropoietin (EPO) gene polymorphisms and diabetic retinopathy: genotype data from a case-control study

description: Genotype data of the rs1617640, rs507392 and rs551238 polymorphisms obtained in a sample of outpatients with type 2 diabetes from Southern Brazil.
<br>
<strong>Supplementary material for: </strong>Sesti LFC, Sbruzzi RC, Polina ER, Soares DS, Crispim D, Canani LH, Santos KG. Association of polymorphisms in the erythropoietin gene with diabetic retinopathy: a case-control study and systematic review with meta-analysis. <em>BMC Ophthalmol</em> <strong>22,</strong> 250 (2022). https://doi.org/10.1186/s12886-022-02467-y
DOI: 10.15468/dl.mtpz9g
title: Occurrence Download

description: A dataset containing 12590 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "TaxonKey is one of (Desmognathus monticola Dunn, 1916)"
 ]
}

 The dataset includes 12590 records from 37 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020619-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.gqv772
title: Occurrence Download

description: A dataset containing 1179 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Rattus norvegicus (Berkenhout, 1769)",
 "Country is Canada",
 "Year is greater than or equal to 1500"
 ]
}

 The dataset includes 1179 records from 22 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020620-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.22khef
title: Occurrence Download

description: A dataset containing 14237 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "TaxonKey is one of (Desmognathus ochrophaeus Cope, 1859)"
 ]
}

 The dataset includes 14237 records from 42 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020621-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5281/zenodo.11225612
title: Supporting materials for: pKa Prediction in Non-Aqueous Solvents

description: This repository includes datasets and supplementary materials for the manuscript: "pKa Prediction in Non-Aqueous Solvents" by Jonathan W. Zheng, Emad Al Ibrahim, and William H. Green. Citations should refer directly to the manuscript:



Zheng, J. W., Al Ibrahim, E., & Green, W. H. (2024). pKa Prediction in Non-Aqueous Solvents. Submitted.


This compilation includes the predicted and experimental pKa values for all compounds studied in the corresponding work, as well as .xyz files corresponding to all conformers used in the COSMO-RS calculations. 

The data from low_error_solvent_preds.csv and high_error_solvent_preds.csv are formatted based on their compilation in the source manuscript: Busch, M., Ahlberg, E., Ahlberg, E., & Laasonen, K. (2022). How to Predict the pKa of Any Compound in Any Solvent. ACS Omega, 7(20), 17369-17383.
DOI: 10.5281/zenodo.11153563
title: Supporting materials for: pKa Prediction in Non-Aqueous Solvents

description: This repository includes datasets and supplementary materials for the manuscript: "pKa Prediction in Non-Aqueous Solvents" by Jonathan W. Zheng, Emad Al Ibrahim, and William H. Green. Citations should refer directly to the manuscript:



Zheng, J. W., Al Ibrahim, E., Kaljurand, I., Leito, I., & Green, W. H. (2024). pKa Prediction in Non-Aqueous Solvents. Journal of Computational Chemistry (2024), doi:10.1002/jcc.27517


This compilation includes the predicted and experimental pKa values for all compounds studied in the corresponding work, as well as .xyz files corresponding to all conformers used in the COSMO-RS calculations. 

For the .csv files, column pKa_exp corresponds to the originally-reported experimental value whereas  pKa_OK corresponds to the corrected value.

The data from low_error_solvent_preds.csv and high_error_solvent_preds.csv and unreliable_solvent_preds.csv are formatted in part based on their compilation in the source manuscript: Busch, M., Ahlberg, E., Ahlberg, E., & Laasonen, K. (2022). How to Predict the pKa of Any Compound in Any Solvent. ACS Omega, 7(20), 17369-17383.

 



Note on version Aug. 28, 2024: fixed erroneous SMILES for several of the benzoic acids in the test set.

Note on version Nov. 18, 2024: updated many of the values in the training and test sets, excluding some values and correcting others. SMILES (and corresponding .xyz files) for two values in the test set were updated.
DOI: 10.5281/zenodo.11153564
title: Supporting materials for: pKa Prediction in Non-Aqueous Solvents

description: This repository includes datasets and supplementary materials for the manuscript: "pKa Prediction in Non-Aqueous Solvents" by Jonathan W. Zheng, Emad Al Ibrahim, and William H. Green. Citations should refer directly to the manuscript.

This compilation includes the predicted and experimental pKa values for all compounds studied in the corresponding work, as well as .xyz files corresponding to all conformers used in the COSMO-RS calculations. 

The data from low_error_solvent_preds.csv and high_error_solvent_preds.csv are formatted based on their compilation in the source manuscript:



Busch, M., Ahlberg, E., Ahlberg, E., & Laasonen, K. (2022). How to Predict the pKa of Any Compound in Any Solvent. ACS Omega, 7(20), 17369-17383.
DOI: 10.5281/zenodo.13395849
title: Supporting materials for: pKa Prediction in Non-Aqueous Solvents

description: This repository includes datasets and supplementary materials for the manuscript: "pKa Prediction in Non-Aqueous Solvents" by Jonathan W. Zheng, Emad Al Ibrahim, and William H. Green. Citations should refer directly to the manuscript:



Zheng, J. W., Al Ibrahim, E., & Green, W. H. (2024). pKa Prediction in Non-Aqueous Solvents. Submitted.


This compilation includes the predicted and experimental pKa values for all compounds studied in the corresponding work, as well as .xyz files corresponding to all conformers used in the COSMO-RS calculations. 

The data from low_error_solvent_preds.csv and high_error_solvent_preds.csv are formatted based on their compilation in the source manuscript: Busch, M., Ahlberg, E., Ahlberg, E., & Laasonen, K. (2022). How to Predict the pKa of Any Compound in Any Solvent. ACS Omega, 7(20), 17369-17383.

Note on version Aug. 28, 2024: fixed erroneous SMILES for several of the benzoic acids in the test set.
DOI: 10.5281/zenodo.14041273
title: Supporting materials for: pKa Prediction in Non-Aqueous Solvents

description: This repository includes datasets and supplementary materials for the manuscript: "pKa Prediction in Non-Aqueous Solvents" by Jonathan W. Zheng, Emad Al Ibrahim, and William H. Green. Citations should refer directly to the manuscript:



Zheng, J. W., Al Ibrahim, E., Kaljurand, I., Leito, I., & Green, W. H. (2024). pKa Prediction in Non-Aqueous Solvents. Journal of Computational Chemistry (2024), doi:10.1002/jcc.27517


This compilation includes the predicted and experimental pKa values for all compounds studied in the corresponding work, as well as .xyz files corresponding to all conformers used in the COSMO-RS calculations. 

For the .csv files, column pKa_exp corresponds to the originally-reported experimental value whereas  pKa_OK corresponds to the corrected value.

The data from low_error_solvent_preds.csv and high_error_solvent_preds.csv and unreliable_solvent_preds.csv are formatted in part based on their compilation in the source manuscript: Busch, M., Ahlberg, E., Ahlberg, E., & Laasonen, K. (2022). How to Predict the pKa of Any Compound in Any Solvent. ACS Omega, 7(20), 17369-17383.

 



Note on version Aug. 28, 2024: fixed erroneous SMILES for several of the benzoic acids in the test set.

Note on version Nov. 18, 2024: updated many of the values in the training and test sets, excluding some values and correcting others. SMILES (and corresponding .xyz files) for two values in the test set were updated.
DOI: 10.15468/dl.2as2c4
title: Occurrence Download

description: A dataset containing 190 species occurrences available in GBIF matching the query:
{
 "and" : [
 "BasisOfRecord is Human Observation",
 "Country is Peru",
 "TaxonKey is Melanosuchus niger (Spix, 1825)"
 ]
}

 The dataset includes 190 records from 5 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020623-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.uxatqx
title: Occurrence Download

description: A dataset containing 14237 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "TaxonKey is one of (Desmognathus ochrophaeus Cope, 1859)"
 ]
}

 The dataset includes 14237 records from 42 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020624-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.4pbryk
title: Occurrence Download

description: A dataset containing 183 species occurrences available in GBIF matching the query:
{
 "and" : [
 "BasisOfRecord is Specimen",
 "Country is Colombia",
 "Geometry POLYGON((-78.64644 7.32454,-80.55449 1.11528,-71.35095 -5.0512,-68.37664 -3.8203,-66.30023 0.04908,-66.8053 6.21,-68.60111 12.68326,-72.64169 12.57374,-78.64644 7.32454))",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "OccurrenceStatus is Present",
 "TaxonKey is Iguana Laurenti, 1768"
 ]
}

 The dataset includes 183 records from 18 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020625-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.5pdzvc
title: Occurrence Download

description: A dataset containing 33310 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Rattus norvegicus (Berkenhout, 1769)",
 "Country is United Kingdom of Great Britain and Northern Ireland",
 "Year is greater than or equal to 1500"
 ]
}

 The dataset includes 33310 records from 102 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020622-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.6bbm2h
title: Occurrence Download

description: A dataset containing 3848 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "TaxonKey is one of (Desmognathus quadramaculatus (Holbrook, 1840))"
 ]
}

 The dataset includes 3848 records from 37 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020626-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.yfspy3
title: Occurrence Download

description: A dataset containing 3848 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "TaxonKey is one of (Desmognathus quadramaculatus (Holbrook, 1840))"
 ]
}

 The dataset includes 3848 records from 37 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020630-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.34683/sr2571
title: StoneRounds Case: SR2571
title: AR Stargardt Disease

description: StoneRounds Case SR2571 was diagnosed with AR Stargardt Disease likely caused by mutations in the gene: ABCA4.
DOI: 10.15468/dl.8m553p
title: Occurrence Download

description: A dataset containing 7 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Rattus norvegicus (Berkenhout, 1769)",
 "Country is French Guiana",
 "Year is greater than or equal to 1500"
 ]
}

 The dataset includes 7 records from 6 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020629-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.xq9tj6
title: Occurrence Download

description: A dataset containing 12358 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Geometry POLYGON((-122.68887 36.76117,-123.00239 36.41476,-122.74593 35.80027,-122.47963 35.62008,-121.30029 35.62008,-121.25591 35.75397,-121.3637 36.07236,-121.77583 36.79672,-122.68887 36.76117))",
 "HasGeospatialIssue is false",
 "OccurrenceStatus is Present",
 "TaxonKey is Sebastes Cuvier, 1829",
 "Year 2009-2016"
 ]
}

 The dataset includes 12358 records from 9 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020631-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.9tsczw
title: Occurrence Download

description: A dataset containing 28 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Rattus norvegicus (Berkenhout, 1769)",
 "Country is New Caledonia",
 "Year is greater than or equal to 1500"
 ]
}

 The dataset includes 28 records from 4 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020633-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.uzx99s
title: Occurrence Download

description: A dataset containing 19632 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "TaxonKey is one of (Eurycea bislineata (Green, 1818))"
 ]
}

 The dataset includes 19632 records from 52 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020632-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.ra2ykw
title: Occurrence Download

description: A dataset containing 1193421 species occurrences available in GBIF matching the query:
{
 "and" : [
 "DatasetKey is iNaturalist Research-grade Observations",
 "Geometry POLYGON((-118.91616 33.42894,-117.53333 33.42894,-117.53333 34.90399,-118.91616 34.90399,-118.91616 33.42894))",
 "HasGeospatialIssue is false",
 "OccurrenceStatus is Present",
 "Year 2013-2023"
 ]
}

 The dataset includes 1193421 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020536-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.fuamwc
title: Occurrence Download

description: A dataset containing 3 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Reticulitermes flavipes (Kollar, 1837)",
 "Country is France",
 "Year is greater than or equal to 1500"
 ]
}

 The dataset includes 3 records from 2 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0020634-241107131044228/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.