47 citations · 108 across the 28 of their papers we have counts for
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cond-mat.mtrl-sci2021★ 1 cited
Polymer Sequence Design via Active Learning
Praneeth S Ramesh, Tarak K Patra
Analysis of molecular scale interactions and chemical structure offers an enormous opportunity to tune material properties for targeted applications. However, designing materials f…
cond-mat.mtrl-sci2021★ 1 cited
Sequence Engineering of Copolymers using Evolutionary Computing
Ashwin A Bale, Tarak K Patra
The correlations between the sequence of monomers in a polymer and its three-dimensional structure is a grand challenge in polymer science and biology. The properties and functions…
cond-mat.mtrl-sci2021
Deep Learning Order Parameter for Polymer Phase Transition
Debjyoti Bhattacharya, Tarak K Patra
We report a deep learning (DL) framework viz. deep autoencoder that autonomously discovers an appropriate order parameter from molecular dynamics (MD) simulation data to characteri…