| New insights into adsorption structure and hydration of polymer at oil-water interface obtained by molecular dynamics simulations: Isotactic poly (methacrylic acid) R Kurapati, U Natarajan Polymer 260, 125378, 2022 | 10 | 2022 |
| Factors Responsible for the Aggregation of Poly (Vinyl Alcohol) in Aqueous Solution as Revealed by Molecular Dynamics Simulations R Kurapati, U Natarajan Industrial & Engineering Chemistry Research 59 (37), 16099-16111, 2020 | 6 | 2020 |
| Tacticity and Ionization Effects on Adsorption Behavior of Poly(acrylic acid) and Poly(methacrylic acid) at the CCl4–H2O Interface Revealed by MD Simulations R Kurapati, U Natarajan Industrial & Engineering Chemistry Research 61 (44), 16500-16516, 2022 | 5 | 2022 |
| Role of Chemical Linkage in Solvation of Polyurethanes in Organic Solvents Studied by Explicit Molecular Dynamics Simulations R Kurapati, U Natarajan Industrial & Engineering Chemistry Research 61 (45), 16883-16894, 2022 | 2 | 2022 |
| Role of concentration and hydrophobic nature of weak polyelectrolytes on adsorption structure and thermodynamics at oil-water interface: Study of several carboxylate polymers R Kurapati, U Natarajan Polymer 285, 126315, 2023 | 1 | 2023 |
| Complex role of chemical nature and tacticity in the adsorption free energy of carboxylic acid polymers at the oil–water interface: molecular dynamics simulations R Kurapati, U Natarajan Physical Chemistry Chemical Physics 25 (40), 27783-27797, 2023 | 1 | 2023 |
| Effect of stereo-chemistry and hydrophilic nature of synthetic carboxylic acid polymers on conformation, intermolecular structure and hydration at air-water interface R Kurapati, U Natarajan Computational Materials Science 230, 112447, 2023 | | 2023 |
