Author

Vidya Niranjan

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#protein folding Open access Oct 2026

Scalable Decoupling Contact and Configuration Spaces in a Quantum-Enabled Protein Folding Workflow

Near-term quantum devices remain constrained by limited qubit counts, noise, and shallow circuit depth, restricting their direct application to peptide folding. This work addresses this limitation through a hybrid quantum–classical framework that separates global contact-space exploration from local configuration-space...

Akshay Uttarkar, Vidya Niranjan · bioRxiv · 0 citations

Aug 2026

Synthesis, Spectral Analysis, Physicochemical, and Biological Potential of Unexplored Novel Indole Tethered Thiazolo[2,3‐c][1,2,4]Triazoles by DFT and Molecular Docking Insights

We here in report the molecular structures of 5‐(5‐substituted‐1 H ‐indol‐3‐yl)‐3‐(4‐substituted‐phenyl)thiazolo[2,3‐c][1,2,4]triazoles 5(a‐l) and their biological activities. Newly synthesized compounds were characterized through FTIR, 1 H & 1 3 C‐NMR and mass spectroscopy. DFT analysis at the B3LYP/6‐311...

Parveen Rajesab, Basavarajaiah Suliphuldevara Mathada, Manjunatha Yarlakatti et al. · ChemistrySelect · 0 citations