27 citations · 51 across the 5 of their papers we have counts for
Showing 2026Show all
2 papers · 1 filter
physics.chem-ph2026
ADEPT-PolyGraphMT: Automated Molecular Simulation and Multi-Task Multi-Fidelity Machine Learning for Polymer Property Generation and Prediction
Sobin Alosious, Yuhan Liu, Jiaxin Xu +4
The discovery of polymers with targeted properties is challenged by the vast chemical design space and the limited availability of consistent, high-quality data across multiple pro…
cond-mat.soft2026
NAVIS: A LAMMPS-Python framework for efficient computation of nanochannel velocity and thermal interfacial slip
Sleeba Varghese, Sobin Alosious, Jesper Schmidt Hansen +1
We present NAVIS (NAnochannel Velocity and thermal Interfacial Slip), a LAMMPS-Python scripted toolkit for computing the Navier (hydrodynamic) friction coefficient and Kapitza (the…