(Q39513261)

12 September 2017

Extracting SAR Information from a Large Collection of Anti-Malarial Screening Hits by NSG-SPT Analysis (English)

1 reference

12 September 2017

0 references

2

Jürgen Bajorath

1 reference

12 September 2017

Mathias Wawer

1

1 reference

12 September 2017

5 January 2011

1 reference

ACS Medicinal Chemistry Letters

12 September 2017

1 reference

12 September 2017

2

1 reference

12 September 2017

3

1 reference

12 September 2017

201-206

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

12 September 2017

1 reference

Data structures and computational tools for the extraction of SAR information from large compound sets

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Thousands of chemical starting points for antimalarial lead identification

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Extended-connectivity fingerprints

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

SARANEA: a freely available program to mine structure-activity and structure-selectivity relationship information in compound data sets

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Navigating structure–activity landscapes

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Toward an improved clustering of large data sets using maximum common substructures and topological fingerprints

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Methods for mining HTS data

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Statistical practice in high-throughput screening data analysis

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Evaluating real-life high-throughput screening data

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

LeadScope: software for exploring large sets of screening data

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Visual exploration of HTS databases: bridging the gap between chemistry and biology.

12 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4018131

Molecular Property eXplorer: a novel approach to visualizing SAR using tree-maps and heatmaps

21 August 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/24900303

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Activity Landscape Representations for Structure−Activity Relationship Analysis

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/24900303

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Structure-activity relationship anatomy by network-like similarity graphs and local structure-activity relationship indices

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/24900303

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1021/ML100240Z

1 reference

12 September 2017

1 reference

PMC publication ID

4018131

12 September 2017

PubMed publication ID

24900303

1 reference

PMC publication ID

4018131