Field-Based QSAR statistics

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Citations per year

Number of citations per year for the bioinformatics software tool Field-Based QSAR
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Protocols

Field-Based QSAR specifications

Information


Unique identifier OMICS_18937
Name Field-Based QSAR
Software type Application/Script
Interface Graphical user interface
Restrictions to use None
Operating system Unix/Linux
Computer skills Medium
Stability Stable
Maintained Yes

Versioning


No version available

Maintainer


  • person_outline QikProp Team

Additional information


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Field-Based QSAR citations

 (3)
library_books

Accelerated bottom up drug design platform enables the discovery of novel stearoyl CoA desaturase 1 inhibitors for cancer therapy

2017
Oncotarget
PMCID: 5787466
PMID: 29416592
DOI: 10.18632/oncotarget.21545

[…] An increasing trend for the use of computational, structure-based studies for accelerating drug discovery and leapfrogging multiple chemical syntheses, with guided 3D-QSAR, or Field-based QSAR, have improved medicinal chemistry studies for drugs [, , , -] such as MK-8931 or SAR707. From virtual screening to de novo design, evaluation of drug-likeness, and further optimizati […]

call_split

A natural chalcone induces apoptosis in lung cancer cells: 3D QSAR, docking and an in vivo/vitro assay

2017
Sci Rep
PMCID: 5587747
PMID: 28878321
DOI: 10.1038/s41598-017-11369-9
call_split See protocol

[…] Lonchocarpin was used as an alignment template for it had the best pIC50 value and the rest of the molecules were aligned to it by the method of flexible ligand alignment (see Supplementary Figure ). Field-based QSAR tool of Schrodinger Suite 2013 was used to develop Gaussian-based QSAR models. Cytotoxic activity of 37 ligands from the Data set against the H292 cancer cell line was considered for […]

library_books

Biological Activity of Coumarin Derivatives as Anti Leishmanial Agents

2016
PLoS One
PMCID: 5074534
PMID: 27768694
DOI: 10.1371/journal.pone.0164585

[…] with the Lipinski’s rule of five and Veber’s rules. Shape based screening method was used for screening of the derivatives and only those compounds with a Tanimoto combo score>0.6 were considered. () Field based QSAR was performed to correlate the physicochemical properties of the compounds with their biological activities. The training set for the QSAR analysis was based on the standard coumarin […]


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