Bhumika Singh

Employment

• Indian Institute of Technology Delhi Project Scientist
  2019 - 2021

Education

• Indian Institute of Technology Delhi Master of Science
  2017 - 2019
• University of Delhi Bachelor of Science (Honors)
  2014 - 2017

Projects & Funding

Projects & funding information is unavailable.

Publications (7)

• How Well Do Molecular Dynamics Force Fields Model Peptides: A Systematic Benchmark across Diverse Folding Behaviors
  The Journal of Physical Chemistry B 2026 2 citations DOI: 10.1021/acs.jpcb.6c01176
  +Save
• Efficient exploration of peptide libraries using active learning with AlphaFold-based screening
  2026 0 citations DOI: 10.64898/2026.04.16.718999
  +Save
• MELD-Adapt: On-the-Fly Belief Updating in Integrative Molecular Dynamics
  Journal of Chemical Theory and Computation 2024 7 citations DOI: 10.1021/acs.jctc.4c00690
  +Save
• A Computational Pipeline for Accurate Prioritization of Protein‐Protein Binding Candidates in High‐Throughput Protein Libraries
  Angewandte Chemie 2024 2 citations DOI: 10.1002/ange.202405767
  +Save
• Structure and energetics guide dynamic behaviour in a T = 3 icosahedral virus capsid
  Biophysical Chemistry 2024 7 citations DOI: 10.1016/j.bpc.2023.107152
  +Save
• Revolutionizing <scp>peptide‐based</scp> drug discovery: Advances in the <scp>post‐AlphaFold</scp> era
  WIREs Computational Molecular Science 2024 55 citations DOI: 10.1002/wcms.1693
  +Save
• Molecular Simulation–Driven Drug Repurposing for the Identification of Inhibitors Against Non-Structural Proteins of SARS-CoV-2
  Methods in Pharmacology and Toxicology 2021 0 citations DOI: 10.1007/7653_2020_61
  +Save