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Proceedings of the National Academy of Sciences of the United States of America
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February 27, 2024
Data-driven classification of ligand unbinding pathways
Dhiman Ray, Michele Parrinello
The Journal of Chemical Physics
|
May 22, 2023
Deep learning collective variables from transition path ensemble
Dhiman Ray, Enrico Trizio, Michele Parrinello
Proceedings of the National Academy of Sciences of the United States of America
|
December 4, 2025
Data-driven enhanced sampling of mechanistic pathways
Revanth Elangovan, Sompriya Chatterjee, Dhiman Ray
Proceedings of the National Academy of Sciences of the United States of America
|
October 7, 2021
Distant residues modulate conformational opening in SARS-CoV-2 spike protein
Dhiman Ray, Ly Le, Ioan Andricioaei
Carbohydrate Polymers
|
September 27, 2014
Influence of sodium carboxymethylcellulose on the aggregation behavior of aqueous 1-hexadecyl-3-methylimidazolium chloride solutions
Bijan Das, Dhiman Ray, Ranjit De
Journal of Chemical Information and Modeling
|
April 12, 2024
Kinetic View of Enzyme Catalysis from Enhanced Sampling QM/MM Simulations
Dhiman Ray, Sudip Das, Umberto Raucci
Journal of Chemical Information and Modeling
|
September 1, 2022
Force-Field-Dependent DNA Breathing Dynamics: A Case Study of Hoogsteen Base Pairing in A6-DNA
Sharon Emily Stone, Dhiman Ray, Ioan Andricioaei
The Journal of Chemical Physics
|
August 19, 2025
Discriminant analysis optimizes progress coordinate in weighted ensemble simulations of rare event kinetics
Praveen Ranganath Prabhakar, Dhiman Ray, Ioan Andricioaei
The Journal of Physical Chemistry. A
|
May 11, 2019
Controlling Electron Dynamics with Carrier-Envelope Phases of a Laser Pulse
Diptesh Dey, Dhiman Ray, Ashwani K Tiwari
The Journal of Chemical Physics
|
March 24, 2019
Effects of alloying on mode-selectivity in H<sub>2</sub>O dissociation on Cu/Ni bimetallic surfaces
Smita Ghosh, Dhiman Ray, Ashwani K Tiwari
Page
of 4
Search research articles
Search
Showing results (11-20 of 32) with videos related to
Sort By:
Page
of 4
Proceedings of the National Academy of Sciences of the United States of America
|
February 27, 2024
Data-driven classification of ligand unbinding pathways
Dhiman Ray, Michele Parrinello
The Journal of Chemical Physics
|
May 22, 2023
Deep learning collective variables from transition path ensemble
Dhiman Ray, Enrico Trizio, Michele Parrinello
Proceedings of the National Academy of Sciences of the United States of America
|
December 4, 2025
Data-driven enhanced sampling of mechanistic pathways
Revanth Elangovan, Sompriya Chatterjee, Dhiman Ray
Proceedings of the National Academy of Sciences of the United States of America
|
October 7, 2021
Distant residues modulate conformational opening in SARS-CoV-2 spike protein
Dhiman Ray, Ly Le, Ioan Andricioaei
Carbohydrate Polymers
|
September 27, 2014
Influence of sodium carboxymethylcellulose on the aggregation behavior of aqueous 1-hexadecyl-3-methylimidazolium chloride solutions
Bijan Das, Dhiman Ray, Ranjit De
Journal of Chemical Information and Modeling
|
April 12, 2024
Kinetic View of Enzyme Catalysis from Enhanced Sampling QM/MM Simulations
Dhiman Ray, Sudip Das, Umberto Raucci
Journal of Chemical Information and Modeling
|
September 1, 2022
Force-Field-Dependent DNA Breathing Dynamics: A Case Study of Hoogsteen Base Pairing in A6-DNA
Sharon Emily Stone, Dhiman Ray, Ioan Andricioaei
The Journal of Chemical Physics
|
August 19, 2025
Discriminant analysis optimizes progress coordinate in weighted ensemble simulations of rare event kinetics
Praveen Ranganath Prabhakar, Dhiman Ray, Ioan Andricioaei
The Journal of Physical Chemistry. A
|
May 11, 2019
Controlling Electron Dynamics with Carrier-Envelope Phases of a Laser Pulse
Diptesh Dey, Dhiman Ray, Ashwani K Tiwari
The Journal of Chemical Physics
|
March 24, 2019
Effects of alloying on mode-selectivity in H<sub>2</sub>O dissociation on Cu/Ni bimetallic surfaces
Smita Ghosh, Dhiman Ray, Ashwani K Tiwari
Page
of 4