Publications by authors named "Susanta Das"

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Forecasting tuberculosis through mechanistic learning of transmission dynamics: Insights from a case study in India.
Adrita Ghosh, Parthasakha Das, Susanta Kumar Das, Pritha Das, Ranjit Kumar Upadhyay

Comput Biol Med· November 2025

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Exploring the Frontiers of Computational NMR: Methods, Applications, and Challenges.
Susanta Das, Kenneth M Merz

Chem Rev· October 2025

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Accurate quantum-centric simulations of intermolecular interactions.
Danil Kaliakin, Akhil Shajan, Fangchun Liang, Javier Robledo Moreno, Zhen Li, Susanta Das

Commun Phys· October 2025

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Designing and field calibration of low-cost microcontroller-based soil moisture sensor for subsurface drip-irrigation system.
Amina Raheja, Rakesh Sharda, Sunil Garg, Samanpreet Kaur, Susanta Das

Sci Rep· October 2025

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Acid-catalysed rearrangement of acyl groups: synthesis of β-d-gluco aminocyclopentitols and carbanucleoside derivatives.
Tapas Halder, Ratul Hore, Susanta Das, Subhadip Sett, Joykrishna Maity

RSC Adv· October 2025

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Synthesis of 1,2,3-Triazole and Tetrazole Appended Glycoconjugates Based on 3,6-Anhydroglucofuranose via Click Reaction.
Susanta Das, Ratul Hore, Sayanta Paria, Gillian Dcosta, Mrinalkanti Kundu

ACS Omega· September 2025

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Structural Bias Effect On Azidation at C‑1 and C‑2 of Alkyl-3,6-anhydro‑d‑hexofuranosides: Synthetic Approach to Natural Products and Derivatives.
Ratul Hore, Koushik Bit, Rajatava Pan, Tapas Halder, Susanta Das

ACS Omega· September 2025

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Toward Quantum-Centric Simulations of Extended Molecules: Sample-Based Quantum Diagonalization Enhanced with Density Matrix Embedding Theory.
Akhil Shajan, Danil Kaliakin, Abhishek Mitra, Javier Robledo Moreno, Zhen Li, Susanta Das

J Chem Theory Comput· July 2025

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Accurate quantum-centric simulations of supramolecular interactions.
Danil Kaliakin, Akhil Shajan, Javier Robledo Moreno, Zhen Li, Abhishek Mitra, Susanta Das

Res Sq· March 2025

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Molecular Gas-Phase Conformational Ensembles.
Susanta Das, Kenneth M Merz

J Chem Inf Model· February 2024

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Rapid and Automated Metabolite Collisional Cross Section Prediction from SMILES Input.
Susanta Das, Laleh Dinpazhoh, Kiyoto Aramis Tanemura, Kenneth M Merz

J Chem Inf Model· August 2023

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Nonlinear optical phase shift in blood plasmas for neoplasia diagnosis.
Md Enamul Hoque, Manash Kanti Biswas, Md Maruf Hossain, Susmita Bhattacharja, Khan Md Enamul Hasan, Susanta Kumar Das

Opt Express· July 2023

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Collision Cross Section Calculations to Aid Metabolite Annotation.
Susanta Das, Kiyoto Aramis Tanemura, Laleh Dinpazhoh, Mithony Keng, Christina Schumm

J Am Soc Mass Spectrom· May 2022

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Quantum Chemistry Calculations for Metabolomics.
Ricardo M Borges, Sean M Colby, Susanta Das, Arthur S Edison, Oliver Fiehn

Chem Rev· May 2021

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AutoGraph: Autonomous Graph-Based Clustering of Small-Molecule Conformations.
Kiyoto Aramis Tanemura, Susanta Das, Kenneth M Merz

J Chem Inf Model· April 2021

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Soil erodibility indices under different land uses in Ri-Bhoi district of Meghalaya (India).
Manish Olaniya, Pradip Kumar Bora, Susanta Das, Pukhrambam Helena Chanu

Sci Rep· September 2020

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Metabolite Structure Assignment Using In Silico NMR Techniques.
Susanta Das, Arthur S Edison, Kenneth M Merz

Anal Chem· August 2020

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A comparative study between the outcomes of visual internal urethrotomy for short segment anterior urethral strictures done under spinal anesthesia and local anesthesia.
Susanta Kumar Das, Debarshi Jana, Bastab Ghosh, Dilip Kumar Pal

Turk J Urol· November 2019

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EnzyDock: Protein-Ligand Docking of Multiple Reactive States along a Reaction Coordinate in Enzymes.
Susanta Das, Mor Shimshi, Keren Raz, Neta Nitoker Eliaz, Anil Ranu Mhashal

J Chem Theory Comput· September 2019

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Superwavelength, wavelength, and subwavelength laser-induced periodic surface structures on zinc and their energy-dispersive x-ray analysis.
Atal Mundamajhi, P Chandrakanta Singh, Susanta Kumar Das

Appl Opt· July 2019

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Distraction during cystoscopy to reduce pain and increase satisfaction: Randomized control study between real-time visualization versus listening to music versus combined music and real-time visualization.
Sandeep Gupta, Susanta Kumar Das, Debarshi Jana, Dilip Kumar Pal

Urol Ann· January 2019

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Total tubeless ultra-mini supine percutaneous nephrolithotomy: A feasibility study.
Sandeep Gupta, Susanta Kumar Das, Dilip Kumar Pal

Turk J Urol· July 2018

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Rapid Convergence of Energy and Free Energy Profiles with Quantum Mechanical Size in Quantum Mechanical-Molecular Mechanical Simulations of Proton Transfer in DNA.
Susanta Das, Kwangho Nam, Dan Thomas Major

J Chem Theory Comput· March 2018

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Acute leukemia masquerading as xanthogranulomatous pyelonephritis.
Sunirmal Choudhury, Susanta Kumar Das, Dilip Kumar Pal

Urol Ann· January 2017

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Is urodynamic study is a necessity for evaluation of lower urinary tract symptoms in postmenopausal female patients? Result of a prospective observational study.
Sunirmal Choudhury, Susanta Kumar Das, Debarshi Jana, Dilip Kumar Pal

Urol Ann· January 2017

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