cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.60712/si-id21890.1
title: StrainInfo SI-ID 21890.1

description: StrainInfo dataset 21890 about a strain of Nakaseomyces glabratus. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21891.1
title: StrainInfo SI-ID 21891.1

description: StrainInfo dataset 21891 about a strain of Cryptococcus neoformans. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21892.1
title: StrainInfo SI-ID 21892.1

description: StrainInfo dataset 21892 about a strain of Pichia kudriavzevii. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21893.1
title: StrainInfo SI-ID 21893.1

description: StrainInfo dataset 21893 about a strain of Fusarium keratoplasticum. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21894.1
title: StrainInfo SI-ID 21894.1

description: StrainInfo dataset 21894 about a strain of Fusarium verticillioides. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.25413/sun.26310190
title: Acacia implexa in South Africa: an emerging invader and potential candidate

description: Invasive alien plant species have major impacts on biodiversity and ecosystem functioning in most parts of the world. Early detection and rapid response is a crucial part of management programmes. Eradication of invasive species at the early stage of invasion is a very cost-effective intervention, but not all species can be eradicated. This paper reports on a study of Acacia implexa, the screw-pod wattle from Australia, an emerging invader, to determine whether it is a suitable candidate for eradication in South Africa. The species was introduced to South Africa in around 1986. Its current range comprises three populations: in Stellenbosch, Tokai and Wolseley. The populations sizes ranges between 100 and 200ha, with the Tokai population covering the largest area but comprising the fewest plants. The density of the plants ranges from very high to very low, with Stellenbosch (Papegaaiberg) having the highest density. The plants reproduce vegetatively (through suckering and resprouting) and sexually (via seeds). A very high occurrence of suckering was present and few seedlings were observed. Spread is mainly along rivers. Current treatments by area managers are unsuccessful for controlling the species. I consider that eradication of this species is feasible. The eradication plan should place strong emphasis on the effective use of herbicides, communication and cooperation between different managerial organizations, and prioritization of treatment efforts.
DOI: 10.25413/sun.26310190.v1
title: Acacia implexa in South Africa: an emerging invader and potential candidate

description: Invasive alien plant species have major impacts on biodiversity and ecosystem functioning in most parts of the world. Early detection and rapid response is a crucial part of management programmes. Eradication of invasive species at the early stage of invasion is a very cost-effective intervention, but not all species can be eradicated. This paper reports on a study of Acacia implexa, the screw-pod wattle from Australia, an emerging invader, to determine whether it is a suitable candidate for eradication in South Africa. The species was introduced to South Africa in around 1986. Its current range comprises three populations: in Stellenbosch, Tokai and Wolseley. The populations sizes ranges between 100 and 200ha, with the Tokai population covering the largest area but comprising the fewest plants. The density of the plants ranges from very high to very low, with Stellenbosch (Papegaaiberg) having the highest density. The plants reproduce vegetatively (through suckering and resprouting) and sexually (via seeds). A very high occurrence of suckering was present and few seedlings were observed. Spread is mainly along rivers. Current treatments by area managers are unsuccessful for controlling the species. I consider that eradication of this species is feasible. The eradication plan should place strong emphasis on the effective use of herbicides, communication and cooperation between different managerial organizations, and prioritization of treatment efforts.
DOI: 10.60712/si-id21895.1
title: StrainInfo SI-ID 21895.1

description: StrainInfo dataset 21895 about a strain of Hypoxylon. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21896.1
title: StrainInfo SI-ID 21896.1

description: StrainInfo dataset 21896 about a strain of Trichophyton rubrum. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21897.1
title: StrainInfo SI-ID 21897.1

description: StrainInfo dataset 21897 about a strain of Mucor circinelloides. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21898.1
title: StrainInfo SI-ID 21898.1

description: StrainInfo dataset 21898 about a strain of Nakaseomyces glabratus. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21899.1
title: StrainInfo SI-ID 21899.1

description: StrainInfo dataset 21899 about a strain of Aspergillus terreus. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21900.1
title: StrainInfo SI-ID 21900.1

description: StrainInfo dataset 21900 about a strain of Aspergillus terreus. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21901.1
title: StrainInfo SI-ID 21901.1

description: StrainInfo dataset 21901 about a strain of Aspergillus fumigatus. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21902.1
title: StrainInfo SI-ID 21902.1

description: StrainInfo dataset 21902 about a strain of Trichophyton benhamiae. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21903.1
title: StrainInfo SI-ID 21903.1

description: StrainInfo dataset 21903 about a strain of Aspergillus fumigatus. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21904.1
title: StrainInfo SI-ID 21904.1

description: StrainInfo dataset 21904 about a strain of Aspergillus flavus. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21905.1
title: StrainInfo SI-ID 21905.1

description: StrainInfo dataset 21905 about a strain of Mucor circinelloides. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21906.1
title: StrainInfo SI-ID 21906.1

description: StrainInfo dataset 21906 about a strain of Microsporum audouinii. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.60712/si-id21907.1
title: StrainInfo SI-ID 21907.1

description: StrainInfo dataset 21907 about a strain of Prototheca blaschkeae. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data.
DOI: 10.17632/p8ndy22t9p
title: Supporting material of: Multistage Molecular Simulations, Design, Synthesis, and Anticonvulsant Evaluation of 2-(Isoindolin-2-yl) Esters of Aromatic Amino Acids Targeting GABAA Receptors via π–π Stacking

description: This is the supporting data of the manuscript entitled: "Multistage Molecular Simulations, Design, Synthesis, and Anticonvulsant Evaluation of 2-(Isoindolin-2-yl) Esters of Aromatic Amino Acids Targeting GABAA Receptors via π–π Stacking".
The deposited data includes:

INDEX

1 General Methods 3
2 Synthesis and Characterization 4
2.1 Synthesis of methyl (S)-(1H-indol-3-yl)-2-(isoindolin-2-yl) propanoate (1) 4
2.2 Synthesis of methyl (S)-3-(4-hydroxyphenyl)-2-(isoindolin-2-yl) propanoate (2) 4
3 Biological assay 6
4 ADMET Profiling of Selected Schiff Base Derivatives 7
5 Plots, Statistical Analysis and Visualizations 13
5.1 Descriptive Statistics 13
6 Structure-Activity Relationship (SAR) 21
6.1 Aromatic Preference and Workflow 21
6.1.1 Library Design: Sixteen Isoindoline Esters Derived from Natural Amino Acids 21
6.1.2 Grouping Compounds by Side Chain Type 21
6.1.3 Summary of Core Properties 22
6.2 Physicochemical and ADMET Filtering 23
6.2.1 Physicochemical Space and CNS Compatibility 23
6.2.2 Hydrogen Bonding Profiles 24
6.2.3 ADMET Prediction Results 24
6.2.4 Conclusion of Filtering Step 24
6.3 Molecular Docking & π–π Interaction Profile 25
6.3.1 Docking Score Comparison and Prioritization 25
6.3.2 Interaction Mapping and Pose Analysis 25
6.3.3 Receptor Environment and Aromatic Selectivity 25
6.3.4 Conclusion 25
6.4 Binding Energy Landscape (Metadynamics) 26
6.4.1 Objective and Rationale 26
6.4.2 Simulation Protocol 26
6.4.3 Free Energy Profiles 27
6.4.4 Interpretation of Binding Modes 27
6.4.5 Summary 27
6.5 Receptor-Specific Interpretation 28
6.5.1 GABAA Receptor Binding Site Characteristics 28
6.5.2 Implications for Ligand Design 28
6.5.3 Mimicry of Classical Benzodiazepines 28
6.5.4 Conclusion 29
6.6 Comparative SAR Insights and Outliers 29
6.6.1 Ranking and Performance Clustering 29
6.6.2 Outlier Analysis 29
6.6.3 Non-Aromatic Class Performance 30
6.6.4 SAR Summary Table Reference 30
6.7 Design Implications and Next-Generation Analogs 30
6.7.1 Key Design Principles 30
6.7.2 Recommended Modifications 30
6.7.3 Broader Application 31
6.7.4 Conclusion 31
6.8 SAR Conclusion 31
7 NMR and MS Specters 33
8 References 39
DOI: 10.17632/p8ndy22t9p.1
title: Supporting material of: Multistage Molecular Simulations, Design, Synthesis, and Anticonvulsant Evaluation of 2-(Isoindolin-2-yl) Esters of Aromatic Amino Acids Targeting GABAA Receptors via π–π Stacking

description: This is the supporting data of the manuscript entitled: "Multistage Molecular Simulations, Design, Synthesis, and Anticonvulsant Evaluation of 2-(Isoindolin-2-yl) Esters of Aromatic Amino Acids Targeting GABAA Receptors via π–π Stacking".
The deposited data includes:

INDEX

1 General Methods 3
2 Synthesis and Characterization 4
2.1 Synthesis of methyl (S)-(1H-indol-3-yl)-2-(isoindolin-2-yl) propanoate (1) 4
2.2 Synthesis of methyl (S)-3-(4-hydroxyphenyl)-2-(isoindolin-2-yl) propanoate (2) 4
3 Biological assay 6
4 ADMET Profiling of Selected Schiff Base Derivatives 7
5 Plots, Statistical Analysis and Visualizations 13
5.1 Descriptive Statistics 13
6 Structure-Activity Relationship (SAR) 21
6.1 Aromatic Preference and Workflow 21
6.1.1 Library Design: Sixteen Isoindoline Esters Derived from Natural Amino Acids 21
6.1.2 Grouping Compounds by Side Chain Type 21
6.1.3 Summary of Core Properties 22
6.2 Physicochemical and ADMET Filtering 23
6.2.1 Physicochemical Space and CNS Compatibility 23
6.2.2 Hydrogen Bonding Profiles 24
6.2.3 ADMET Prediction Results 24
6.2.4 Conclusion of Filtering Step 24
6.3 Molecular Docking & π–π Interaction Profile 25
6.3.1 Docking Score Comparison and Prioritization 25
6.3.2 Interaction Mapping and Pose Analysis 25
6.3.3 Receptor Environment and Aromatic Selectivity 25
6.3.4 Conclusion 25
6.4 Binding Energy Landscape (Metadynamics) 26
6.4.1 Objective and Rationale 26
6.4.2 Simulation Protocol 26
6.4.3 Free Energy Profiles 27
6.4.4 Interpretation of Binding Modes 27
6.4.5 Summary 27
6.5 Receptor-Specific Interpretation 28
6.5.1 GABAA Receptor Binding Site Characteristics 28
6.5.2 Implications for Ligand Design 28
6.5.3 Mimicry of Classical Benzodiazepines 28
6.5.4 Conclusion 29
6.6 Comparative SAR Insights and Outliers 29
6.6.1 Ranking and Performance Clustering 29
6.6.2 Outlier Analysis 29
6.6.3 Non-Aromatic Class Performance 30
6.6.4 SAR Summary Table Reference 30
6.7 Design Implications and Next-Generation Analogs 30
6.7.1 Key Design Principles 30
6.7.2 Recommended Modifications 30
6.7.3 Broader Application 31
6.7.4 Conclusion 31
6.8 SAR Conclusion 31
7 NMR and MS Specters 33
8 References 39
DOI: 10.15468/dl.65m2dh
title: Occurrence Download

description: A dataset containing 589 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Grevillea robusta A.Cunn. ex R.Br.",
 "Country is Argentina",
 "HasCoordinate is true"
 ]
}

 The dataset includes 589 records from 4 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0081601-250525065834625/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.3xvs8n
title: Occurrence Download

description: A dataset containing 23 species occurrences available in GBIF matching the query:
{
 "and" : [
 "PublishingOrg is 28eb1a3f-1c15-4a95-931a-4af90ecb574d",
 "TaxonKey is Anolis occultus Williams & Rivero, 1965"
 ]
}

 The dataset includes 23 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0081600-250525065834625/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.2qk6kg
title: Occurrence Download

description: A dataset containing 5 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Grevillea robusta A.Cunn. ex R.Br.",
 "Country is Jamaica",
 "HasCoordinate is true"
 ]
}

 The dataset includes 5 records from 2 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0081602-250525065834625/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.17632/9sdh6jm638.1
title: Frequency and Ordering Patterns of Autoantibody Tests Across Morphea Subtypes

description: This dataset summarizes the frequency and ordering patterns of 14 autoantibody tests, including four scleroderma-specific tests (ANA, anti–Scl–70, anti–RNA polymerase III, and anti–centromere), across morphea subtypes in 544 patients over 5 years. The data, collected through a retrospective chart review, show that scleroderma specific tests are frequently ordered across all morphea subtypes, despite their limited clinical utility. No significant differences in testing frequency were observed between subtypes. These findings suggest potential overuse of autoimmune serologies and support the need for more targeted testing guidelines in morphea.
DOI: 10.15468/dl.7u3u5x
title: Occurrence Download

description: A dataset containing 308545 species occurrences available in GBIF matching the query:
{
 "DatasetKey" : [
 "is Activité générale du bureau d'étude BIOTOPE (1994 - 2013) - Données acquises dans le cadre de l'activité du bureau d'étude BIOTOPE (1994 - 2013)"
 ]
}

 The dataset includes 308545 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0081590-250525065834625/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.dfgwxh
title: Occurrence Download

description: A dataset containing 471 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Grevillea robusta A.Cunn. ex R.Br.",
 "Country is South Africa",
 "HasCoordinate is true"
 ]
}

 The dataset includes 471 records from 5 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0081603-250525065834625/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.34740/kaggle/dsv/12332791
title: Peer-to-Peer Boliviano (BOB) Exchange Data
DOI: 10.17632/rmmnrr9t4r
title: Cuerpo, territorio y memoria: la partería en comunidades afrodescendientes. Colombia

description: En un proyecto de investigación de mestría en Salud Colectiva que aborda el tema de los saberes ancestrales en la partería por parte de mujeres de Nuquí (Choco)
DOI: 10.17632/rmmnrr9t4r.1
title: Cuerpo, territorio y memoria: la partería en comunidades afrodescendientes. Colombia

description: En un proyecto de investigación de mestría en Salud Colectiva que aborda el tema de los saberes ancestrales en la partería por parte de mujeres de Nuquí (Choco)
DOI: 10.15468/dl.pnfu8w
title: Occurrence Download

description: A dataset containing 24 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasGeospatialIssue is false",
 "HasCoordinate is true",
 "OccurrenceStatus is Present",
 {
 "not" : {
 "BasisOfRecord" : [
 "is one of (Fossil, Material sample)"
 ]
 }
 },
 "TaxonKey is Melanocorypha bimaculata (Ménétriés, 1832)",
 "Continent is one of (Africa)",
 "Year is greater than or equal to 1900"
 ]
}

 The dataset includes 24 records from 5 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0081605-250525065834625/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.cab3ua
title: Occurrence Download

description: A dataset containing 21143 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Heterotheca subaxillaris (Lam.) Britton & Rusby"
 ]
}

 The dataset includes 21143 records from 235 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0081604-250525065834625/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.17632/3kvpv6xt8h.2
title: Associations between intakes of food groups recommended by the Dietary Guidelines for Americans and iron status in subsets of the US population: a cross-sectional study

description: To determine how food groups recommended in the Dietary Guidelines for Americans relate to dietary iron intake and iron status in subsets of the US population, multivariate regressions were used to examine associations between Healthy Eating Index (HEI) total and component scores with dietary iron intake and iron status indicators [body iron, ferritin, soluble transferrin receptor, serum iron, transferrin saturation, hemoglobin, hematocrit) in males (12+ y, n=2420), females of reproductive age (12-49 y, n=9757), young children (2-5 y, n=4058), and toddlers (12-23 mo, n=1132) from NHANES 2003-18. Differences in body iron by quintiles of HEI total and composite scores were assessed with least-squared mean regressions. Covariate adjustments included age, ethnicity, body-mass-index, poverty-income-ratio, smoking, and supplemental iron intake. To explore specific foods contributing to associations, the top 3 foods consumed for each HEI component were identified in each analysis subset.
DOI: 10.17632/n3bvtr2fph
title: Comparison of the effectiveness and treatment patterns of anti-IL-23 and anti-IL-17A after anti-IL-17A failure in psoriatic patients: a single-center, retrospective study

description: Background: An increasing number of psoriasis patients are experiencing secondary failure with interleukin (IL)-17A inhibitors, highlighting the urgency to identify effective switching strategies. 

Objectives: Evaluated the effectiveness and treatment patterns of intraclass versus interclass switching therapies in psoriasis patients experiencing secondary failure to IL-17A inhibitors over a 28-week period. 

Methods: This retrospective analysis included psoriasis patients who experienced secondary failure of IL-17A inhibitors and subsequently switching to either an IL-23 inhibitor (inter-class switching group) or an alternative IL-17A inhibitor (intra-class switching group). 

Results: 80 patients were enrolled, including 47 in the intra-class switching group and 33 in the inter-class switching group. The mean psoriasis area and severity index (PASI) scores and dermatology life quality index (DLQI) scores were significantly lower in the intra-class switching group compared to the inter-class switching group at each time point over 28 weeks (P&lt;0.05). The discontinuation rate was significantly higher in the inter-class switching group (24.1%) compared to the intra-class switching group (2.7%; P&lt;0.05). Previous exposure to ≥2 biologics working on different pathways was identified as a risk factor for treatment failure in the inter-class switching group. 

Conclusion: Intra-class switching provides superior treatment outcomes compared to inter-class switching in patients experiencing secondary failure to IL-17A inhibitors.
DOI: 10.17632/n3bvtr2fph.1
title: Comparison of the effectiveness and treatment patterns of anti-IL-23 and anti-IL-17A after anti-IL-17A failure in psoriatic patients: a single-center, retrospective study

description: Background: An increasing number of psoriasis patients are experiencing secondary failure with interleukin (IL)-17A inhibitors, highlighting the urgency to identify effective switching strategies. 

Objectives: Evaluated the effectiveness and treatment patterns of intraclass versus interclass switching therapies in psoriasis patients experiencing secondary failure to IL-17A inhibitors over a 28-week period. 

Methods: This retrospective analysis included psoriasis patients who experienced secondary failure of IL-17A inhibitors and subsequently switching to either an IL-23 inhibitor (inter-class switching group) or an alternative IL-17A inhibitor (intra-class switching group). 

Results: 80 patients were enrolled, including 47 in the intra-class switching group and 33 in the inter-class switching group. The mean psoriasis area and severity index (PASI) scores and dermatology life quality index (DLQI) scores were significantly lower in the intra-class switching group compared to the inter-class switching group at each time point over 28 weeks (P&lt;0.05). The discontinuation rate was significantly higher in the inter-class switching group (24.1%) compared to the intra-class switching group (2.7%; P&lt;0.05). Previous exposure to ≥2 biologics working on different pathways was identified as a risk factor for treatment failure in the inter-class switching group. 

Conclusion: Intra-class switching provides superior treatment outcomes compared to inter-class switching in patients experiencing secondary failure to IL-17A inhibitors.