B.Tech. Mechanical Engineering, NIT Silchar, India (2018)
Areas of Interest
Condensed Matter Physics
Quantum Computing
Mathematical Modelling
Experience
2021-Present: Graduate Student, Pritzker School of Molecular Engineering, University of Chicago
2019-2021: Worked on projects involving reduced-order modelling, machine learning and computational chemistry
at the Institute for Applied and Computational Mathematics, RWTH Aachen University, Germany (Supervisor - Prof. Dr Benjamin Stamm)
2019-2020: Construction of Markov state models from molecular dynamics trajectories of Aβ simulation at the Forschungszentrum
Jülich, Germany (Supervisor - Prof. Dr Birgit Strodel)
Summer 2017: Studying the collective behavior of run-reverse-flick motion exhibiting bacteria/micro-swimmers using
MD simulation at the Max Planck Institute for Dynamics and Self-Organization in Göttingen, Germany (Supervisor - Dr Marco Mazza)
Awards and Academic Achievements
Dean's List, RWTH Aachen University (2020)
DAAD-WISE Scholarship (2017)
Publications
Arghadwip Paul*, Suman Samantray*, Marco Anteghini, Mohammed Khaled, and Birgit Strodel (*equal contribution) Thermodynamics and kinetics of the amyloid-β peptide revealed by Markov state models based on MD data in agreement with experiment Chem. Sci., 12, 6652 (2021)
Franz Bamer, Somar Shekh Alshabab, Arghadwip Paul, Firaz Ebrahem, Bernd Markert, and Benjamin Stamm Data-driven classification of elementary rearrangement events in silica glass Scripta Materialia, 205, 114179 (2021)
Suman Samantray, Wibke Schumann, Alexander-Maurice Illig, Martin Carballo-Pacheco, Arghadwip Paul, Bogdan Barz, and Birgit Strodel Molecular dynamics simulations of protein aggregation: protocols for simulation setup and analysis with Markov state models and transition networks bioRxiv 2020.04.25.060269 (2020)