Identifications of good and bad structural fragments of hydrazone/2, 5-disubstituted-1, 3, 4-oxadiazole hybrids with correlation intensity index and consensus …
The application of QSAR along with other in silico tools like molecular docking, and
molecular dynamics provide a lot of promise for finding new treatments for life-threatening …
molecular dynamics provide a lot of promise for finding new treatments for life-threatening …
Synthesis, molecular docking and QSAR study of thiazole clubbed pyrazole hybrid as α-amylase inhibitor
In search of potent α-amylase inhibitors, herein we report the synthesis, molecular docking
and QSAR study of some thiazole clubbed pyrazole hybrids (TCPH) ie, 1-((1-phenyl-3-aryl-1 …
and QSAR study of some thiazole clubbed pyrazole hybrids (TCPH) ie, 1-((1-phenyl-3-aryl-1 …
QSAR study of new compounds based on 1, 2, 4-triazole as potential anticancer agents
Pancreatic cancer is an aggressive cancer, usually with poor prognosis, as it is mostly
discovered at an advanced stage of development where treatment is challenging. Using …
discovered at an advanced stage of development where treatment is challenging. Using …
Application of the LAD-LASSO as a dimensional reduction technique in the ANN-based QSAR study: Discovery of potent inhibitors using molecular docking simulation
In this study, the combination of the least absolute deviation-least absolute shrinkage and
selection operator (LAD-LASSO) was introduced as a new variable selection method for the …
selection operator (LAD-LASSO) was introduced as a new variable selection method for the …
CORAL: probing the structural requirements for α-amylase inhibition activity of 5-(3-arylallylidene)-2-(arylimino) thiazolidin-4-one derivatives based on QSAR with …
The present study aims to examine the structural requirements governing α-amylase
inhibitory activity of 5-(3-arylallylidene)-2-(arylimino) thiazolidin-4-one derivatives and their …
inhibitory activity of 5-(3-arylallylidene)-2-(arylimino) thiazolidin-4-one derivatives and their …
Exploring biological efficacy of novel benzothiazole linked 2, 5-disubstituted-1, 3, 4-oxadiazole hybrids as efficient α-amylase inhibitors: Synthesis, characterization …
In an effort to explore a class of novel antidiabetic agents, we have made an effort to
synergize the α-amylase inhibitory potential of 1, 3-benzothiazole and 1, 3, 4-oxadiazole …
synergize the α-amylase inhibitory potential of 1, 3-benzothiazole and 1, 3, 4-oxadiazole …
[PDF][PDF] 2D QSAR analysis on oxadiazole derivatives as anticancer agents
SK Jain, AK Yadav, P Nayak - Int J Curr Pharm Res, 2011 - academia.edu
Two dimensional quantitative structure activity relationship (2D QSAR) study by means of
partial least square regression (PLSR) method was performed on a series of 3-(aryl)-N-(aryl) …
partial least square regression (PLSR) method was performed on a series of 3-(aryl)-N-(aryl) …
Monte Carlo method based QSAR modelling of natural lipase inhibitors using hybrid optimal descriptors
Obesity is one of the most provoking health burdens in the developed countries. One of the
strategies to prevent obesity is the inhibition of pancreatic lipase enzyme. The aim of this …
strategies to prevent obesity is the inhibition of pancreatic lipase enzyme. The aim of this …
Parsing structural fragments of thiazolidin-4-one based α-amylase inhibitors: A combined approach employing in vitro colorimetric screening and GA-MLR based …
Abstract α-Amylase (EC. 3.2. 1.1) is a ubiquitous digestive endoamylase. The abrupt rise in
blood glucose levels due to the hydrolysis of carbohydrates by α-amylase at a faster rate is …
blood glucose levels due to the hydrolysis of carbohydrates by α-amylase at a faster rate is …
Quantitative structure activity relationship studies of novel hydrazone derivatives as α-amylase inhibitors with index of ideality of correlation
The present manuscript describes the synthesis, α-amylase inhibition, in silico studies and in-
depth quantitative structure–activity relationship (QSAR) of a library of aroyl hydrazones …
depth quantitative structure–activity relationship (QSAR) of a library of aroyl hydrazones …