Role of Hydrotropes in Sparingly Soluble Drug Solubilization: Insight from a Molecular Dynamics Simulation and Experimental Perspectives R Paul#, KG Chattaraj#, S Paul Langmuir 37 (16), 4745–4762, 2021 | 42 | 2021 |
Inclusion of Theobromine Modifies Uric Acid Aggregation with Possible Changes in Melamine-Uric Acid Clusters Responsible for Kidney Stones KG Chattaraj, S Paul The Journal of Physical Chemistry B 123 (49), 10483–10504, 2019 | 26 | 2019 |
Underlying mechanistic insights into the structural properties of melamine and uric acid complexes with compositional variation under ambient conditions KG Chattaraj, S Paul The Journal of Chemical Physics 151 (5), 054503, 2019 | 16 | 2019 |
Understanding of structure and thermodynamics of melamine association in aqueous solution from a unified theoretical and experimental approach KG Chattaraj, S Paul Journal of chemical information and modeling 58 (8), 1610-1624, 2018 | 16 | 2018 |
How does temperature modulate the structural properties of aggregated melamine in aqueous solution—An answer from classical molecular dynamics simulation KG Chattaraj, S Paul The Journal of chemical physics 150 (6), 064501, 2019 | 14 | 2019 |
Switching of Self-Assembly to Solvent-Assisted Assembly of Molecular Motor: Unveiling the Mechanisms of Dynamic Control on Solvent Exchange KG Chattaraj, R Paul, S Paul Langmuir 36 (7), 1773-1792, 2020 | 11 | 2020 |
The Miscibility and Solubility of Uric Acid and Vitamin C in the Solution Phase and Their Structural Alignment in the Solid-Liquid Interface KG Chattaraj, S Paul Physical Chemistry Chemical Physics 23, 15169-15182, 2021 | 10 | 2021 |
Underlying Mechanisms of Allopurinol in Eliminating Renal Toxicity Induced by Melamine-Uric Acid Complex Formation: A Computational Study KG Chattaraj, S Paul Chemical Research in Toxicology 34 (9), 2054–2069, 2021 | 10 | 2021 |
Elucidating the Hydrotropic Mechanism of the Antagonistic Salt PPh4Cl A Mitra#, KG Chattaraj#, S Paul The Journal of Physical Chemistry B 127 (4), 996-1012, 2023 | 4 | 2023 |
Appraising the Potency of Small Molecule Inhibitors and Their Graphene Surface-Mediated Organizational Attributes on Uric Acid-Melamine Clusters KG Chattaraj, S Paul Physical Chemistry Chemical Physics 24, 1029-1047, 2022 | 4 | 2022 |
Investigation on the Mechanisms of Synchronous Interaction of K3Cit with Melamine and Uric Acid That Avoids the Formation of Large Clusters KG Chattaraj, S Paul Journal of chemical information and modeling 60 (10), 4827–4844, 2020 | 3 | 2020 |
Enhanced O-glycosylation Site Prediction Using Explainable Machine Learning Technique with Spatial Local Environment S Hong#, KG Chattaraj#, J Guo, BL Trout, RD Braatz Bioinformatics 41 (2), btaf034, 2025 | | 2025 |
The role of aggregation of melamine and uric acid in kidney stone formation and its inhibition by small molecule inhibitors in solution and at the solid liquid interface a … KG Chattaraj IIT Guwahati, 2021 | | 2021 |