Relationships between Molecular Complexity, Biological Activity, and Structural Diversity.
about
Sequential application of ligand and structure based modeling approaches to index chemicals for their hH4R antagonismExploring chemical space for drug discovery using the chemical universe database.Self-Organizing Maps for In Silico Screening and Data Visualization.Lessons learnt from assembling screening libraries for drug discovery for neglected diseases.Novel Algorithms for the Identification of Biologically Informative Chemical Diversity Metrics.Experimental validation of a fragment library for lead discovery using SPR biosensor technology.Recent trends and observations in the design of high-quality screening collections.Visualisation of the chemical space of fragments, lead-like and drug-like molecules in PubChem.Small molecules of different origins have distinct distributions of structural complexity that correlate with protein-binding profiles.Locating sweet spots for screening hits and evaluating pan-assay interference filters from the performance analysis of two lead-like librariesQuantifying structure and performance diversity for sets of small molecules comprising small-molecule screening collections.Highly Stereoselective Synthesis of a Compound Collection Based on the Bicyclic Scaffolds of Natural Products.Ligand discovery and virtual screening using the program LIDAEUS.Pharmacological modulators of the circadian clock as potential therapeutic drugs.The central role of chemistry in 'quality by design' approaches to drug development.Increasing the coverage of medicinal chemistry-relevant space in commercial fragments screening.Rendering conventional molecular fingerprints for virtual screening independent of molecular complexity and size effects.Quantitative Structure-Activity Relationship Model for HCVNS5B inhibitors based on an Antlion Optimizer-Adaptive Neuro-Fuzzy Inference System.Directed functionalization of 1,2-dihydropyridines: stereoselective synthesis of 2,6-disubstituted piperidines.Early development drug formulation on a chip: fabrication of nanoparticles using a microfluidic spray dryer.Exploring G Protein-Coupled Receptors (GPCRs) Ligand Space via Cheminformatics Approaches: Impact on Rational Drug Design.Pharmacological modulators of the circadian clock as potential therapeutic drugs.
P2860
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P2860
Relationships between Molecular Complexity, Biological Activity, and Structural Diversity.
description
2006 nî lūn-bûn
@nan
2006 թուականի Մարտին հրատարակուած գիտական յօդուած
@hyw
2006 թվականի մարտին հրատարակված գիտական հոդված
@hy
2006年の論文
@ja
2006年論文
@yue
2006年論文
@zh-hant
2006年論文
@zh-hk
2006年論文
@zh-mo
2006年論文
@zh-tw
2006年论文
@wuu
name
Relationships between Molecula ...... ity, and Structural Diversity.
@ast
Relationships between Molecula ...... ity, and Structural Diversity.
@en
type
label
Relationships between Molecula ...... ity, and Structural Diversity.
@ast
Relationships between Molecula ...... ity, and Structural Diversity.
@en
prefLabel
Relationships between Molecula ...... ity, and Structural Diversity.
@ast
Relationships between Molecula ...... ity, and Structural Diversity.
@en
P2093
P356
P1433
P1476
Relationships between Molecula ...... ity, and Structural Diversity.
@en
P2093
Ansgar Schuffenhauer
Edgar Jacoby
Paul Selzer
P304
P356
10.1021/CI0503558
P577
2006-03-01T00:00:00Z