Author

Vijay Pande

Listed by name: these papers carry no ORCID for this author, so different people with the same name may be mixed together.

Biology Disciplines

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Biophysics· 1 Microbiology· 1

Signature Assays, Organisms & Methods

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Approach:Bayesian inference· 1 Approach:deep learning· 1 Research Focus:drug response / drug discovery· 1 Research Focus:protein folding & dynamics· 1 Assay:proteomics· 1

Frequent Co-Authors

Bowen Liu· 1 shared Claude Nagamine· 1 shared David A. Constant· 1 shared Jasmine MoshiriiD· 1 shared Karla Kirkegaard· 1 shared Kyle Beauchamp· 1 shared Paul Novick· 1 shared Rhiju Das· 1 shared

Activity by Year

2014-2020 · peak 1/yr

Co-Author Collaboration Network

10 top collaborators · 29 mutual co-author links

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1 shared paperMicrobiology

Bowen Liu

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2 papers

Recent·Most cited

A targeted computational screen of the SWEETLEAD database reveals FDA-approved compounds with anti-dengue viral activity

Jasmine Moshiri, David A. Constant, Bowen Liu, Roberto Mateo, Steven Kearnes, Paul Novick, Ritika Prasad, Claude Nagamine, Vijay Pande, Karla Kirkegaard

The paper identifies three FDA-approved compounds with anti-dengue activity using computational screening of a safe-in-human database, revealing their potential molecular targets and mechanisms.

mBio · Dec 22, 2020Peer-reviewedMicrobiology

Bayesian Energy Landscape Tilting: Towards Concordant Models of Molecular Ensembles

Kyle Beauchamp, Vijay Pande, Rhiju Das

This paper introduces BELT, a Bayesian framework that computes conformational ensembles from experimental data and discordant simulations, achieving accurate predictions for disordered proteins.

bioRxiv · Jan 24, 2014Biophysics