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Akshay Uttarkar

Showing results (1-10 of 33) with videos related to

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International Journal of Biological Macromolecules|June 11, 2024
Quantum synergy in peptide folding: A comparative study of CVaR-variational quantum eigensolver and molecular dynamics simulationAkshay Uttarkar, Vidya Niranjan
Computers in Biology and Medicine|March 21, 2023
Carboxymuconolactone decarboxylase is a prospective molecular target for multi-drug resistant Acinetobacter baumannii-computational modeling, molecular docking and dynamic simulation studiesShraddha Rana, Sinosh Skariyachan, Akshay Uttarkar, et al.
Methods in Molecular Biology (Clifton, N.J.)|October 13, 2022
A Machine Learning-Based Approach Using Multi-omics Data to Predict Metabolic PathwaysVidya Niranjan, Akshay Uttarkar, Aakaanksha Kaul, et al.
Journal of Molecular Modeling|February 6, 2024
Disaggregation of amyloid-beta fibrils via natural metabolites using long timescale replica exchange molecular dynamics simulation studiesAkshay Uttarkar, Vibha Rao, Dhrithi Bhat, et al.
Plos One|August 3, 2023
Protocol for the development of coarse-grained structures for macromolecular simulation using GROMACSVidya Niranjan, Purushotham Rao, Akshay Uttarkar, et al.
Plos One|February 11, 2026
QuPepFold: A python package for hybrid quantum-classical protein folding simulations with CVaR-optimized VQEAkshay Uttarkar, Vidya Niranjan, Amit Saxena, et al.
Proteins|January 5, 2023
Computational design of prospective molecular targets for Burkholderia cepacia complex by molecular docking and dynamic simulation studiesSinosh Skariyachan, Prinith Kaveramma Uluvangada Praveen, Akshay Uttarkar, et al.
Molecules (Basel, Switzerland)|January 8, 2023
Design of Novel Coumarin Derivatives as NUDT5 Antagonists That Act by Restricting ATP Synthesis in Breast Cancer CellsVidya Niranjan, Sanjana Jayaprasad, Akshay Uttarkar, et al.
Molecular Biotechnology|July 14, 2024
Computational Insights into Papaveroline as an In Silico Drug Candidate for Alzheimer's Disease via Fyn Tyrosine Kinase InhibitionShreya Satyanarayan Bhat, Spoorthi R Kulkarni, Akshay Uttarkar, et al.
Computers in Biology and Medicine|March 22, 2021
Structural insights on the interaction potential of natural leads against major protein targets of SARS-CoV-2: Molecular modelling, docking and dynamic simulation studiesSinosh Skariyachan, Dharshini Gopal, Aditi G Muddebihalkar, et al.
Pageof 4

Showing results (1-10 of 33) with videos related to

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Pageof 4
International Journal of Biological Macromolecules|June 11, 2024
Quantum synergy in peptide folding: A comparative study of CVaR-variational quantum eigensolver and molecular dynamics simulationAkshay Uttarkar, Vidya Niranjan
Computers in Biology and Medicine|March 21, 2023
Carboxymuconolactone decarboxylase is a prospective molecular target for multi-drug resistant Acinetobacter baumannii-computational modeling, molecular docking and dynamic simulation studiesShraddha Rana, Sinosh Skariyachan, Akshay Uttarkar, et al.
Methods in Molecular Biology (Clifton, N.J.)|October 13, 2022
A Machine Learning-Based Approach Using Multi-omics Data to Predict Metabolic PathwaysVidya Niranjan, Akshay Uttarkar, Aakaanksha Kaul, et al.
Journal of Molecular Modeling|February 6, 2024
Disaggregation of amyloid-beta fibrils via natural metabolites using long timescale replica exchange molecular dynamics simulation studiesAkshay Uttarkar, Vibha Rao, Dhrithi Bhat, et al.
Plos One|August 3, 2023
Protocol for the development of coarse-grained structures for macromolecular simulation using GROMACSVidya Niranjan, Purushotham Rao, Akshay Uttarkar, et al.
Plos One|February 11, 2026
QuPepFold: A python package for hybrid quantum-classical protein folding simulations with CVaR-optimized VQEAkshay Uttarkar, Vidya Niranjan, Amit Saxena, et al.
Proteins|January 5, 2023
Computational design of prospective molecular targets for Burkholderia cepacia complex by molecular docking and dynamic simulation studiesSinosh Skariyachan, Prinith Kaveramma Uluvangada Praveen, Akshay Uttarkar, et al.
Molecules (Basel, Switzerland)|January 8, 2023
Design of Novel Coumarin Derivatives as NUDT5 Antagonists That Act by Restricting ATP Synthesis in Breast Cancer CellsVidya Niranjan, Sanjana Jayaprasad, Akshay Uttarkar, et al.
Molecular Biotechnology|July 14, 2024
Computational Insights into Papaveroline as an In Silico Drug Candidate for Alzheimer's Disease via Fyn Tyrosine Kinase InhibitionShreya Satyanarayan Bhat, Spoorthi R Kulkarni, Akshay Uttarkar, et al.
Computers in Biology and Medicine|March 22, 2021
Structural insights on the interaction potential of natural leads against major protein targets of SARS-CoV-2: Molecular modelling, docking and dynamic simulation studiesSinosh Skariyachan, Dharshini Gopal, Aditi G Muddebihalkar, et al.
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