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The Journal of Physical Chemistry. B|April 14, 2026
How Well Do Molecular Dynamics Force Fields Model Peptides: A Systematic Benchmark across Diverse Folding BehaviorsBhumika Singh, Yisel Martínez-Noa, Alberto Perez
Biorxiv : the Preprint Server for Biology|August 6, 2025
How Well Do Molecular Dynamics Force Fields Model Peptides? A Systematic Benchmark Across Diverse Folding BehaviorsBhumika Singh, Yisel Martínez-Noa, Alberto Perez
Wiley Interdisciplinary Reviews. Computational Molecular Science|April 29, 2024
Revolutionizing Peptide-Based Drug Discovery: Advances in the Post-AlphaFold EraLiwei Chang, Arup Mondal, Bhumika Singh, et al.
The Journal of Physical Chemistry. B|April 14, 2026
Ensemble Sensitivity to Chemical Modifications in Free and Bound Macrocyclic PeptidesYisel Martínez-Noa, Wen-Ting Chen, Cheng-Yu Li, et al.
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