Author

Tanvi P. Gujarati

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Preprint Oct 2026

Sample-based quantum simulation of vibrational structure of polyyne chains

Predicting anharmonic vibrational spectra is a complex computational task, which becomes quickly infeasible as molecular size and the number of vibrational basis functions increase, leading to an exponential growth of the underlying Hilbert space. Here, we employ a sample-based quantum diagonalization (SQD) framework t...

Sarah Mostame, Tanvi P. Gujarati, Alberto Baiardi et al. · 0 citations

Open access Jul 2026

Quantum convolutional HLA immunogenic peptide prediction (Q-CHIPP): Next-generation neoantigen prediction with quantum neural network

This work introduces Quantum Convolutional HLA Immunogenic Peptide Prediction (Q-CHIPP), a combinatorial framework integrating MHC binding and T-cell recognition that targets HLA-A*02:01–restricted 9-mer peptides and identifies those peptides known to be immunogenic, improving the prognostic impact of predicted neoanti...

Ryan Peters, Kahn Rhrissorrakrai, Prerana Bangalore Parthasarathy et al. · Science Advances · 0 citations