Comparison of molecular fingerprint methods on the basis of biological profile data.
about
Crystal structure-based virtual screening for fragment-like ligands of the human histamine H(1) receptorComparing structural fingerprints using a literature-based similarity benchmarkA fast topological analysis algorithm for large-scale similarity evaluations of ligands and binding pocketsRational methods for the selection of diverse screening compoundsEnhancing adverse drug event detection in electronic health records using molecular structure similarity: application to pancreatitisQSAR model based on weighted MCS trees approach for the representation of molecule data sets.Progress in the analysis of multiple activity profile of screening data using computational approaches.Exploiting Pharmacological Similarity to Identify Safety Concerns - Listen to What the Data Tells You.Fragment library screening reveals remarkable similarities between the G protein-coupled receptor histamine H₄ and the ion channel serotonin 5-HT₃A.Metabolite identification and molecular fingerprint prediction through machine learning.Limits of ligand selectivity from docking to models: in silico screening for A(1) adenosine receptor antagonistsToward an efficient approach to identify molecular scaffolds possessing selective or promiscuous compounds.Selecting, Acquiring, and Using Small Molecule Libraries for High-Throughput Screening.Drug-drug interaction through molecular structure similarity analysis.Graph-based similarity concepts in virtual screening.Progress in the Visualization and Mining of Chemical and Target Spaces.Matched Molecular Pair Analysis in Short: Algorithms, Applications and LimitationsStructure-based virtual screening for fragment-like ligands of the G protein-coupled histamine H4 receptorGetting SMARt in drug discovery: chemoinformatics approaches for mining structure–multiple activity relationships
P2860
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P2860
Comparison of molecular fingerprint methods on the basis of biological profile data.
description
2009 nî lūn-bûn
@nan
2009 թուականի Փետրուարին հրատարակուած գիտական յօդուած
@hyw
2009 թվականի փետրվարին հրատարակված գիտական հոդված
@hy
2009年の論文
@ja
2009年論文
@yue
2009年論文
@zh-hant
2009年論文
@zh-hk
2009年論文
@zh-mo
2009年論文
@zh-tw
2009年论文
@wuu
name
Comparison of molecular fingerprint methods on the basis of biological profile data.
@ast
Comparison of molecular fingerprint methods on the basis of biological profile data.
@en
type
label
Comparison of molecular fingerprint methods on the basis of biological profile data.
@ast
Comparison of molecular fingerprint methods on the basis of biological profile data.
@en
prefLabel
Comparison of molecular fingerprint methods on the basis of biological profile data.
@ast
Comparison of molecular fingerprint methods on the basis of biological profile data.
@en
P2093
P356
P1476
Comparison of molecular fingerprint methods on the basis of biological profile data.
@en
P2093
Andreas Steffen
Christian Tyrchan
Thierry Kogej
P304
P356
10.1021/CI800326Z
P50
P577
2009-02-01T00:00:00Z