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Polamarasetty Aparoy

Showing results (1-10 of 29) with videos related to

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Journal of Biomolecular Structure & Dynamics|March 17, 2016
Deciphering the mechanism behind the varied binding activities of COXIBs through Molecular Dynamic Simulations, MM-PBSA binding energy calculations and per-residue energy decomposition studiesNeha Chaudhary, Polamarasetty Aparoy
Heliyon|October 21, 2020
Application of per-residue energy decomposition to identify the set of amino acids critical for <i>in silico</i> prediction of COX-2 inhibitory activityNeha Chaudhary, Polamarasetty Aparoy
International Journal of Biological Macromolecules|March 26, 2016
Insights into the structure activity relationship of mPGES-1 inhibitors: Hints for better inhibitor designAshish Gupta, Polamarasetty Aparoy
Royal Society Open Science|June 12, 2015
Graphlet signature-based scoring method to estimate protein-ligand binding affinityOmkar Singh, Kunal Sawariya, Polamarasetty Aparoy
International Journal of Biological Macromolecules|July 22, 2018
MM-PBSA and per-residue decomposition energy studies on 7-Phenyl-imidazoquinolin-4(5H)-one derivatives: Identification of crucial site points at microsomal prostaglandin E synthase-1 (mPGES-1) active siteAshish Gupta, Neha Chaudhary, Polamarasetty Aparoy
Current Topics in Medicinal Chemistry|July 21, 2018
Role of Topological, Electronic, Geometrical, Constitutional and Quantum Chemical Based Descriptors in QSAR: mPGES-1 as a Case StudyAshish Gupta, Virender Kumar, Polamarasetty Aparoy
Protein and Peptide Letters|March 9, 2010
Development of tools and database for analysis of metal binding sites in proteinBhusan Kumar Kuntal, Polamarasetty Aparoy, Pallu Reddanna
BMC Research Notes|August 18, 2010
EasyModeller: A graphical interface to MODELLERBhusan K Kuntal, Polamarasetty Aparoy, Pallu Reddanna
Current Medicinal Chemistry|June 12, 2012
Structure and ligand based drug design strategies in the development of novel 5- LOX inhibitorsPolamarasetty Aparoy, Kakularam Kumar Reddy, Pallu Reddanna
Scientific Reports|January 30, 2026
Computational strategies for unraveling insights from known inhibitors for further lead optimization: A case study on Celecoxib analoguesSonam Grewal, Biswayan Ghosh, Ujjwal Narayan, et al.
Pageof 3

Showing results (1-10 of 29) with videos related to

Sort By:
Pageof 3
Journal of Biomolecular Structure & Dynamics|March 17, 2016
Deciphering the mechanism behind the varied binding activities of COXIBs through Molecular Dynamic Simulations, MM-PBSA binding energy calculations and per-residue energy decomposition studiesNeha Chaudhary, Polamarasetty Aparoy
Heliyon|October 21, 2020
Application of per-residue energy decomposition to identify the set of amino acids critical for <i>in silico</i> prediction of COX-2 inhibitory activityNeha Chaudhary, Polamarasetty Aparoy
International Journal of Biological Macromolecules|March 26, 2016
Insights into the structure activity relationship of mPGES-1 inhibitors: Hints for better inhibitor designAshish Gupta, Polamarasetty Aparoy
Royal Society Open Science|June 12, 2015
Graphlet signature-based scoring method to estimate protein-ligand binding affinityOmkar Singh, Kunal Sawariya, Polamarasetty Aparoy
International Journal of Biological Macromolecules|July 22, 2018
MM-PBSA and per-residue decomposition energy studies on 7-Phenyl-imidazoquinolin-4(5H)-one derivatives: Identification of crucial site points at microsomal prostaglandin E synthase-1 (mPGES-1) active siteAshish Gupta, Neha Chaudhary, Polamarasetty Aparoy
Current Topics in Medicinal Chemistry|July 21, 2018
Role of Topological, Electronic, Geometrical, Constitutional and Quantum Chemical Based Descriptors in QSAR: mPGES-1 as a Case StudyAshish Gupta, Virender Kumar, Polamarasetty Aparoy
Protein and Peptide Letters|March 9, 2010
Development of tools and database for analysis of metal binding sites in proteinBhusan Kumar Kuntal, Polamarasetty Aparoy, Pallu Reddanna
BMC Research Notes|August 18, 2010
EasyModeller: A graphical interface to MODELLERBhusan K Kuntal, Polamarasetty Aparoy, Pallu Reddanna
Current Medicinal Chemistry|June 12, 2012
Structure and ligand based drug design strategies in the development of novel 5- LOX inhibitorsPolamarasetty Aparoy, Kakularam Kumar Reddy, Pallu Reddanna
Scientific Reports|January 30, 2026
Computational strategies for unraveling insights from known inhibitors for further lead optimization: A case study on Celecoxib analoguesSonam Grewal, Biswayan Ghosh, Ujjwal Narayan, et al.
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