Academic Qualifications
- B.Sc.Bankura District College (BSU)
- M.Sc.IIT Kharagpur
- Ph.D.Julius Maximilian University of Würzburg, Germany
- Postdoctoral ResearchUniversity of Lugano, Switzerland; IIT Genova, Italy
Teaching Experience
Courses Taught (UG)
Physical Chemistry
Computational Chemistry
Courses Taught (PG)
Molecular Modeling
Advanced Simulation Techniques
Courses Taught (PhD)
Enhanced Sampling Methods
ML for Chemical Systems
Subject Expertise
- Core ExpertiseMolecular Dynamics Simulations
- Core ExpertiseEnhanced Sampling Techniques
- Core ExpertiseMachine Learning for Chemistry
- Interdisciplinary ExpertiseComputational Materials Science
- Interdisciplinary ExpertisePharmaceutical Modeling
Research Interests
- Research Area 1Enhanced Sampling (ES) Methods
- Research Area 2Machine Learning (ML) in Chemistry
- Research Area 3ML for Materials and Pharmaceuticals
- Research Area 4Multi-scale Modeling of Nano-bio Systems
- Research Area 5Atomically Precise Metal Nanoclusters
Awards & Honors
- AwardTeaching Excellence Award, IIT Delhi (2023–2024)
- AwardAssociate of the Indian Academy of Sciences (2023)
- AwardEarly Career Researcher Prize in Molecular Physics (2022)
Professional Memberships
Membership
Member
American Chemical Society
Membership
Member
Society for Materials Chemistry (SMC)
BARC
Editorial Roles
- Editorial BoardJournal of Physical Chemistry (ACS)
Publications
- Selected PublicationModeling Enzyme-like Catalytic Reactions on Ligand-protected Metal Nanoclusters
- Selected PublicationAtomic-scale Nanocluster Formation from Machine-Learned Potential-based Simulations
- Selected PublicationDeep Learning Simulations of RNA–Peptide Binding