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Identification of ligand efficient, fragment-like hits from an HTS library: structure-based virtual screening and docking investigations of 2H- and 3H-pyrazolo tautomers for Aurora kinase A selectivity.
Sarvagalla, Sailu; Singh, Vivek Kumar; Ke, Yi-Yu; Shiao, Hui-Yi; Lin, Wen-Hsing; Hsieh, Hsing-Pang; Hsu, John T A; Coumar, Mohane Selvaraj.
Affiliation
  • Sarvagalla S; Centre for Bioinformatics, School of Life Sciences, Pondicherry University, Kalapet, 605014, Puducherry, India.
J Comput Aided Mol Des ; 29(1): 89-100, 2015 Jan.
Article in En | MEDLINE | ID: mdl-25344840

Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Structure-Activity Relationship / Protein Kinase Inhibitors / Drug Evaluation, Preclinical / High-Throughput Screening Assays / Aurora Kinase A Type of study: Diagnostic_studies / Prognostic_studies / Screening_studies Limits: Humans Language: En Journal: J Comput Aided Mol Des Journal subject: BIOLOGIA MOLECULAR / ENGENHARIA BIOMEDICA Year: 2015 Document type: Article Affiliation country: Country of publication:

Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Structure-Activity Relationship / Protein Kinase Inhibitors / Drug Evaluation, Preclinical / High-Throughput Screening Assays / Aurora Kinase A Type of study: Diagnostic_studies / Prognostic_studies / Screening_studies Limits: Humans Language: En Journal: J Comput Aided Mol Des Journal subject: BIOLOGIA MOLECULAR / ENGENHARIA BIOMEDICA Year: 2015 Document type: Article Affiliation country: Country of publication: