Sentence examples for molecular field analyses from inspiring English sources
Hansch and comparative molecular field analyses gave coherent results suggesting the main structural requirements of high receptor binding affinity.
Comparative molecular field analyses (CoMFA) and hologram quantitative structure activity relationships (HQSAR) were conducted on a large set of ERα modulators.
The comparative molecular field analyses (CoMFA) and comparative molecular similarity indices analyses (CoMSIA) based 3D-QSAR models were derived using pharmacophore-based alignment.
Hundreds of chemicals were synthesized by numerous authors, ranging from the well-known and very efficient 4-OHA to complicated imidazole or indane derivatives tested by sophisticated comparative molecular field analyses.
The comparative molecular field analyses (CoMFA) [ 18, 25– 30] and the comparative molecular similarity indices analyses (CoMSIA) [ 18, 27– 32] for Chk2 inhibitors were performed by ligand-based and receptor-guided alignment.
We then related these data to 3D QSAR CoMFA and CoMSIA analyses (comparative molecular field analysis, comparative molecular similarity indices analysis, respectively).
Ligand-based 3D-QSAR analyses by comparative molecular field analysis (CoMFA), comparative molecular shape indices analysis (CoMSIA) and Field-Based 3D-QSAR evaluated a series of 102 members of this class.
Based on the binding conformations and their alignment inside the binding pocket of CCR5, three-dimensional structure activity relationship (3D QSAR) analyses were performed on these antagonists using comparative molecular field analysis (CoMFA) and comparative molecular similarity analysis (CoMSIA) methods.
The 3D QSAR analyses of antimalarial alkoxylated and hydroxylated chalcones were first conducted by Comparative molecular field analysis (CoMFA) and Comparative similarity indices analysis (CoMSIA) to determine the factors required for the activity of these compounds.
comparative molecular field analysis.
Comparative molecular field analysis (CoMFA). 1.
