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Chemosphere
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October 6, 2014
Single-descriptor based quantum-chemical QSPRs for physico-chemical properties of polychlorinated-dibenzo-p-dioxins and -dibenzo-furans (PCDD/Fs): exploring the role of electron-correlation
Vikas, Chayawan
Environmental Pollution (Barking, Essex : 1987)
|
August 3, 2016
Quantum-mechanical parameters for the risk assessment of multi-walled carbon-nanotubes: A study using adsorption of probe compounds and its application to biomolecules
Chayawan, Vikas
Journal of Hazardous Materials
|
April 28, 2015
Externally predictive single-descriptor based QSPRs for physico-chemical properties of polychlorinated-naphthalenes: Exploring relationships of logS(W), logK(OA), and logK(OW) with electron-correlation
Chayawan, Vikas
Chemosphere
|
October 31, 2013
Externally predictive quantitative modeling of supercooled liquid vapor pressure of polychlorinated-naphthalenes through electron-correlation based quantum-mechanical descriptors
Vikas, Chayawan
Journal of Molecular Graphics & Modelling
|
March 19, 2013
Does electron-correlation has any role in the quantitative structure-activity relationships?
Vikas, Reenu, Chayawan
Molecules (Basel, Switzerland)
|
February 13, 2020
Towards an Understanding of the Mode of Action of Human Aromatase Activity for Azoles through Quantum Chemical Descriptors-Based Regression and Structure Activity Relationship Modeling Analysis
Chayawan Chayawan, Cosimo Toma, Emilio Benfenati, et al.
Molecules (Basel, Switzerland)
|
February 25, 2023
A KNIME Workflow to Assist the Analogue Identification for Read-Across, Applied to Aromatase Activity
Ana Yisel Caballero Alfonso, Chayawan Chayawan, Domenico Gadaleta, et al.
Methods (San Diego, Calif.)
|
July 3, 2023
Method for highly selective, ultrasensitive fluorimetric detection of Cu<sup>2+</sup> and Al<sup>3+</sup> by Schiff bases containing o-phenylenediamine and o-aminophenol
Shivani Sharma, Chayawan, Joy Debnath, et al.
Toxicology in Vitro : an International Journal Published in Association with BIBRA
|
February 17, 2022
Exploration of structural requirements for azole chemicals towards human aromatase CYP19A1 activity: Classification modeling, structure-activity relationships and read-across study
Ana Y Caballero Alfonso, Liadys Mora Lagares, Marjana Novic, et al.
Toxicology
|
January 30, 2022
Skin sensitization quantitative QSAR models based on mechanistic structural alerts
Chayawan, Gianluca Selvestrel, Diego Baderna, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 12) with videos related to
Sort By:
Page
of 2
Chemosphere
|
October 6, 2014
Single-descriptor based quantum-chemical QSPRs for physico-chemical properties of polychlorinated-dibenzo-p-dioxins and -dibenzo-furans (PCDD/Fs): exploring the role of electron-correlation
Vikas, Chayawan
Environmental Pollution (Barking, Essex : 1987)
|
August 3, 2016
Quantum-mechanical parameters for the risk assessment of multi-walled carbon-nanotubes: A study using adsorption of probe compounds and its application to biomolecules
Chayawan, Vikas
Journal of Hazardous Materials
|
April 28, 2015
Externally predictive single-descriptor based QSPRs for physico-chemical properties of polychlorinated-naphthalenes: Exploring relationships of logS(W), logK(OA), and logK(OW) with electron-correlation
Chayawan, Vikas
Chemosphere
|
October 31, 2013
Externally predictive quantitative modeling of supercooled liquid vapor pressure of polychlorinated-naphthalenes through electron-correlation based quantum-mechanical descriptors
Vikas, Chayawan
Journal of Molecular Graphics & Modelling
|
March 19, 2013
Does electron-correlation has any role in the quantitative structure-activity relationships?
Vikas, Reenu, Chayawan
Molecules (Basel, Switzerland)
|
February 13, 2020
Towards an Understanding of the Mode of Action of Human Aromatase Activity for Azoles through Quantum Chemical Descriptors-Based Regression and Structure Activity Relationship Modeling Analysis
Chayawan Chayawan, Cosimo Toma, Emilio Benfenati, et al.
Molecules (Basel, Switzerland)
|
February 25, 2023
A KNIME Workflow to Assist the Analogue Identification for Read-Across, Applied to Aromatase Activity
Ana Yisel Caballero Alfonso, Chayawan Chayawan, Domenico Gadaleta, et al.
Methods (San Diego, Calif.)
|
July 3, 2023
Method for highly selective, ultrasensitive fluorimetric detection of Cu<sup>2+</sup> and Al<sup>3+</sup> by Schiff bases containing o-phenylenediamine and o-aminophenol
Shivani Sharma, Chayawan, Joy Debnath, et al.
Toxicology in Vitro : an International Journal Published in Association with BIBRA
|
February 17, 2022
Exploration of structural requirements for azole chemicals towards human aromatase CYP19A1 activity: Classification modeling, structure-activity relationships and read-across study
Ana Y Caballero Alfonso, Liadys Mora Lagares, Marjana Novic, et al.
Toxicology
|
January 30, 2022
Skin sensitization quantitative QSAR models based on mechanistic structural alerts
Chayawan, Gianluca Selvestrel, Diego Baderna, et al.
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of 2