2 citations · 3 across the 2 of their papers we have counts for
2 papers
q-bio.BM2024★ 2 cited
Optimizing adaptive sampling via Policy Ranking
Hassan Nadeem, Diwakar Shukla
Efficient sampling in biomolecular simulations is critical for accurately capturing the complex dynamical behaviors of biological systems. Adaptive sampling techniques aim to impro…
q-bio.BM2023★ 1 cited
Adaptive Sampling Methods for Molecular Dynamics in the Era of Machine Learning
Diego E. Kleiman, Hassan Nadeem, Diwakar Shukla
Molecular Dynamics (MD) simulations are fundamental computational tools for the study of proteins and their free energy landscapes. However, sampling protein conformational changes…