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Rohit Modee

Showing results (1-10 of 5) with videos related to

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Journal of Computational Chemistry|December 6, 2021
Benchmark study on deep neural network potentials for small organic moleculesRohit Modee, Siddhartha Laghuvarapu, U Deva Priyakumar
The Journal of Physical Chemistry. B|November 28, 2023
MolOpt: Autonomous Molecular Geometry Optimization Using Multiagent Reinforcement LearningRohit Modee, Sarvesh Mehta, Siddhartha Laghuvarapu, et al.
Physical Chemistry Chemical Physics : PCCP|September 27, 2021
DART: deep learning enabled topological interaction model for energy prediction of metal clusters and its application in identifying unique low energy isomersRohit Modee, Sheena Agarwal, Ashwini Verma, et al.
Journal of Computational Chemistry|May 3, 2024
Deep reinforcement learning in chemistry: A reviewBhuvanesh Sridharan, Animesh Sinha, Jai Bardhan, et al.
Scientific Data|September 7, 2022
PLAS-5k: Dataset of Protein-Ligand Affinities from Molecular Dynamics for Machine Learning ApplicationsDivya B Korlepara, C S Vasavi, Shruti Jeurkar, et al.
Pageof 1

Showing results (1-10 of 5) with videos related to

Sort By:
Pageof 1
Journal of Computational Chemistry|December 6, 2021
Benchmark study on deep neural network potentials for small organic moleculesRohit Modee, Siddhartha Laghuvarapu, U Deva Priyakumar
The Journal of Physical Chemistry. B|November 28, 2023
MolOpt: Autonomous Molecular Geometry Optimization Using Multiagent Reinforcement LearningRohit Modee, Sarvesh Mehta, Siddhartha Laghuvarapu, et al.
Physical Chemistry Chemical Physics : PCCP|September 27, 2021
DART: deep learning enabled topological interaction model for energy prediction of metal clusters and its application in identifying unique low energy isomersRohit Modee, Sheena Agarwal, Ashwini Verma, et al.
Journal of Computational Chemistry|May 3, 2024
Deep reinforcement learning in chemistry: A reviewBhuvanesh Sridharan, Animesh Sinha, Jai Bardhan, et al.
Scientific Data|September 7, 2022
PLAS-5k: Dataset of Protein-Ligand Affinities from Molecular Dynamics for Machine Learning ApplicationsDivya B Korlepara, C S Vasavi, Shruti Jeurkar, et al.
Pageof 1