A quality alert and call for improved curation of public chemistry databases
about
Scientific Lenses to Support Multiple Views over Linked Chemistry DataComputational and Practical Aspects of Drug RepositioningOpen PHACTS: semantic interoperability for drug discoveryThe ChEMBL database as linked open dataConsistency of systematic chemical identifiers within and between small-molecule databasesMachines first, humans second: on the importance of algorithmic interpretation of open chemistry dataThe Chemical Validation and Standardization Platform (CVSP): large-scale automated validation of chemical structure datasetsQSAR modeling: where have you been? Where are you going to?Why open drug discovery needs four simple rules for licensing data and modelsActivity, assay and target data curation and quality in the ChEMBL databaseParallel worlds of public and commercial bioactive chemistry dataBigger data, collaborative tools and the future of predictive drug discoveryCheminformatics and the Semantic Web: adding value with linked data and enhanced provenancePublic domain databases for medicinal chemistryDispensing processes impact apparent biological activity as determined by computational and statistical analyses.From data point timelines to a well curated data set, data mining of experimental data and chemical structure data from scientific articles, problems and possible solutions.Data sharing matters.Are bigger data sets better for machine learning? Fusing single-point and dual-event dose response data for Mycobacterium tuberculosisTales from the war on error: the art and science of curating QSAR data.Extending in silico mechanism-of-action analysis by annotating targets with pathways: application to cellular cytotoxicity readouts.Quality Issues with Public Domain Chemogenomics Data.A generalizable pre-clinical research approach for orphan disease therapyChemo- and bioinformatics resources for in silico drug discovery from medicinal plants beyond their traditional use: a critical review.Predicting organ toxicity using in vitro bioactivity data and chemical structure.Experimental Errors in QSAR Modeling Sets: What We Can Do and What We Cannot Do.Modern approaches to accelerate discovery of new antischistosomal drugs.Extensions to In Silico Bioactivity Predictions Using Pathway Annotations and Differential Pharmacology Analysis: Application to Xenopus laevis Phenotypic Readouts.Toward Good Read-Across Practice (GRAP) guidanceThe CompTox Chemistry Dashboard: a community data resource for environmental chemistry.Maximizing computational tools for successful drug discovery.Annotation of Peptide Structures Using SMILES and Other Chemical Codes-Practical Solutions.Exploring G Protein-Coupled Receptors (GPCRs) Ligand Space via Cheminformatics Approaches: Impact on Rational Drug Design.
P2860
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P2860
A quality alert and call for improved curation of public chemistry databases
description
2011 nî lūn-bûn
@nan
2011 թուականի Սեպտեմբերին հրատարակուած գիտական յօդուած
@hyw
2011 թվականի սեպտեմբերին հրատարակված գիտական հոդված
@hy
2011年の論文
@ja
2011年論文
@yue
2011年論文
@zh-hant
2011年論文
@zh-hk
2011年論文
@zh-mo
2011年論文
@zh-tw
2011年论文
@wuu
name
A quality alert and call for improved curation of public chemistry databases
@ast
A quality alert and call for improved curation of public chemistry databases
@en
type
label
A quality alert and call for improved curation of public chemistry databases
@ast
A quality alert and call for improved curation of public chemistry databases
@en
prefLabel
A quality alert and call for improved curation of public chemistry databases
@ast
A quality alert and call for improved curation of public chemistry databases
@en
P1433
P1476
A quality alert and call for improved curation of public chemistry databases
@en
P2093
Antony J. Williams
P304
P356
10.1016/J.DRUDIS.2011.07.007
P577
2011-07-30T00:00:00Z