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Journal of Biomolecular Structure & Dynamics
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July 13, 2016
In silico studies on potential MCF-7 inhibitors: a combination of pharmacophore and 3D-QSAR modeling, virtual screening, molecular docking, and pharmacokinetic analysis
Bharti Badhani, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
January 12, 2019
An insight into selective and potent inhibition of histone deacetylase 8 through induced-fit docking, pharmacophore modeling and QSAR studies
Kriti Kashyap, Rita Kakkar
Medchemcomm
|
April 19, 2019
Isatin and its derivatives: a survey of recent syntheses, reactions, and applications
Varun, Sonam, Rita Kakkar
Free Radical Research
|
November 13, 2020
The effect of solvent polarity on the antioxidant potential of echinatin, a retrochalcone, towards various ROS: a DFT thermodynamic study
Ankit Mittal, Rita Kakkar
Phytochemistry
|
October 1, 2021
The antioxidant potential of retrochalcones isolated from liquorice root: A comparative DFT study
Ankit Mittal, Rita Kakkar
Computers in Biology and Medicine
|
July 14, 2020
Pharmacophore-enabled virtual screening, molecular docking and molecular dynamics studies for identification of potent and selective histone deacetylase 8 inhibitors
Kriti Kashyap, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
January 5, 2020
Exploring structural requirements of isoform selective histone deacetylase inhibitors: a comparative <i>in silico</i> study
Kriti Kashyap, Rita Kakkar
ACS Applied Materials & Interfaces
|
October 14, 2017
Hierarchical Porous Magnesium Oxide (Hr-MgO) Microspheres for Adsorption of an Organophosphate Pesticide: Kinetics, Isotherm, Thermodynamics, and DFT Studies
Lekha Sharma, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
June 23, 2022
A combination strategy of structure-based virtual screening, MM-GBSA, cross docking, molecular dynamics and metadynamics simulations used to investigate natural compounds as potent and specific inhibitors of tumor linked human carbonic anhydrase IX
Varun Chahal, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
May 28, 2005
Theoretical study of molecular recognition by Hoechst 33258 derivatives
Rita Kakkar, Suruchi, Rajni Grover
Page
of 4
Search research articles
Search
Showing results (1-10 of 40) with videos related to
Sort By:
Page
of 4
Journal of Biomolecular Structure & Dynamics
|
July 13, 2016
In silico studies on potential MCF-7 inhibitors: a combination of pharmacophore and 3D-QSAR modeling, virtual screening, molecular docking, and pharmacokinetic analysis
Bharti Badhani, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
January 12, 2019
An insight into selective and potent inhibition of histone deacetylase 8 through induced-fit docking, pharmacophore modeling and QSAR studies
Kriti Kashyap, Rita Kakkar
Medchemcomm
|
April 19, 2019
Isatin and its derivatives: a survey of recent syntheses, reactions, and applications
Varun, Sonam, Rita Kakkar
Free Radical Research
|
November 13, 2020
The effect of solvent polarity on the antioxidant potential of echinatin, a retrochalcone, towards various ROS: a DFT thermodynamic study
Ankit Mittal, Rita Kakkar
Phytochemistry
|
October 1, 2021
The antioxidant potential of retrochalcones isolated from liquorice root: A comparative DFT study
Ankit Mittal, Rita Kakkar
Computers in Biology and Medicine
|
July 14, 2020
Pharmacophore-enabled virtual screening, molecular docking and molecular dynamics studies for identification of potent and selective histone deacetylase 8 inhibitors
Kriti Kashyap, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
January 5, 2020
Exploring structural requirements of isoform selective histone deacetylase inhibitors: a comparative <i>in silico</i> study
Kriti Kashyap, Rita Kakkar
ACS Applied Materials & Interfaces
|
October 14, 2017
Hierarchical Porous Magnesium Oxide (Hr-MgO) Microspheres for Adsorption of an Organophosphate Pesticide: Kinetics, Isotherm, Thermodynamics, and DFT Studies
Lekha Sharma, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
June 23, 2022
A combination strategy of structure-based virtual screening, MM-GBSA, cross docking, molecular dynamics and metadynamics simulations used to investigate natural compounds as potent and specific inhibitors of tumor linked human carbonic anhydrase IX
Varun Chahal, Rita Kakkar
Journal of Biomolecular Structure & Dynamics
|
May 28, 2005
Theoretical study of molecular recognition by Hoechst 33258 derivatives
Rita Kakkar, Suruchi, Rajni Grover
Page
of 4