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Journal of Computational Chemistry
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September 24, 2017
A component analysis of the free energies of folding of 35 proteins: A consensus view on the thermodynamics of folding at the molecular level
Debarati DasGupta, Varun Mandalaparthy, Bhyravabhotla Jayaram
Journal of Chemical Information and Modeling
|
April 25, 2019
Free Energies and Entropies of Binding Sites Identified by MixMD Cosolvent Simulations
Phani Ghanakota, Debarati DasGupta, Heather A Carlson
Journal of Chemical Information and Modeling
|
February 2, 2022
Computational Identification of Possible Allosteric Sites and Modulators of the SARS-CoV-2 Main Protease
Debarati DasGupta, Wallace K B Chan, Heather A Carlson
ACS Applied Bio Materials
|
May 4, 2023
Identifying Potential Ligand Binding Sites on Glycogen Synthase Kinase 3 Using Atomistic Cosolvent Simulations
Debarati DasGupta, Ramin Mehrani, Heather A Carlson, et al.
Journal of Computational Chemistry
|
September 8, 2021
Mixed-solvent molecular dynamics simulation-based discovery of a putative allosteric site on regulator of G protein signaling 4
Wallace K B Chan, Debarati DasGupta, Heather A Carlson, et al.
Indian Journal of Ophthalmology
|
September 11, 2024
Long-term follow-up after lens-sparing vitrectomy for complications of retinopathy of prematurity
Lingam Gopal, Pramod Bhende, Chetan Rao, et al.
Indian Journal of Ophthalmology
|
October 28, 2021
Using artificial intelligence for diabetic retinopathy screening: Policy implications
Rajiv Raman, Debarati Dasgupta, Kim Ramasamy, et al.
Scientific Reports
|
February 22, 2023
Sunsetting Binding MOAD with its last data update and the addition of 3D-ligand polypharmacology tools
Swapnil Wagle, Richard D Smith, Anthony J Dominic, et al.
Journal of Cellular Biochemistry
|
June 20, 2022
Investigating binding mechanism of thymoquinone to human transferrin, targeting Alzheimer's disease therapy
Bin Xue, Debarati DasGupta, Manzar Alam, et al.
Frontiers in Pharmacology
|
October 5, 2023
Mechanistic insights into MARK4 inhibition by galantamine toward therapeutic targeting of Alzheimer's disease
Mohd Adnan, Debarati DasGupta, Saleha Anwar, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 18) with videos related to
Sort By:
Page
of 2
Journal of Computational Chemistry
|
September 24, 2017
A component analysis of the free energies of folding of 35 proteins: A consensus view on the thermodynamics of folding at the molecular level
Debarati DasGupta, Varun Mandalaparthy, Bhyravabhotla Jayaram
Journal of Chemical Information and Modeling
|
April 25, 2019
Free Energies and Entropies of Binding Sites Identified by MixMD Cosolvent Simulations
Phani Ghanakota, Debarati DasGupta, Heather A Carlson
Journal of Chemical Information and Modeling
|
February 2, 2022
Computational Identification of Possible Allosteric Sites and Modulators of the SARS-CoV-2 Main Protease
Debarati DasGupta, Wallace K B Chan, Heather A Carlson
ACS Applied Bio Materials
|
May 4, 2023
Identifying Potential Ligand Binding Sites on Glycogen Synthase Kinase 3 Using Atomistic Cosolvent Simulations
Debarati DasGupta, Ramin Mehrani, Heather A Carlson, et al.
Journal of Computational Chemistry
|
September 8, 2021
Mixed-solvent molecular dynamics simulation-based discovery of a putative allosteric site on regulator of G protein signaling 4
Wallace K B Chan, Debarati DasGupta, Heather A Carlson, et al.
Indian Journal of Ophthalmology
|
September 11, 2024
Long-term follow-up after lens-sparing vitrectomy for complications of retinopathy of prematurity
Lingam Gopal, Pramod Bhende, Chetan Rao, et al.
Indian Journal of Ophthalmology
|
October 28, 2021
Using artificial intelligence for diabetic retinopathy screening: Policy implications
Rajiv Raman, Debarati Dasgupta, Kim Ramasamy, et al.
Scientific Reports
|
February 22, 2023
Sunsetting Binding MOAD with its last data update and the addition of 3D-ligand polypharmacology tools
Swapnil Wagle, Richard D Smith, Anthony J Dominic, et al.
Journal of Cellular Biochemistry
|
June 20, 2022
Investigating binding mechanism of thymoquinone to human transferrin, targeting Alzheimer's disease therapy
Bin Xue, Debarati DasGupta, Manzar Alam, et al.
Frontiers in Pharmacology
|
October 5, 2023
Mechanistic insights into MARK4 inhibition by galantamine toward therapeutic targeting of Alzheimer's disease
Mohd Adnan, Debarati DasGupta, Saleha Anwar, et al.
Page
of 2