Structure and hydrogen bonding of water in polyacrylate gels: Effects of polymer hydrophilicity and water concentration S Mani, F Khabaz, RV Godbole, RC Hedden, R Khare The Journal of Physical Chemistry B 119 (49), 15381-15393, 2015 | 53 | 2015 |
Molecular origins of dynamic coupling between water and hydrated polyacrylate gels F Khabaz, S Mani, R Khare Macromolecules 49 (19), 7551-7562, 2016 | 27 | 2016 |
OpenMSCG: A Software Tool for Bottom-Up Coarse-Graining Y Peng, AJ Pak, AEP Durumeric, PG Sahrmann, S Mani, J Jin, TD Loose, ... The Journal of Physical Chemistry B, 2023 | 19 | 2023 |
Compressive and Tensile Deformations Alter ATP Hydrolysis and Phosphate Release Rates in Actin Filaments S Mani, HH Katkar, GA Voth Journal of Chemical Theory and Computation 17 (3), 1900-1913, 2021 | 14 | 2021 |
Anisotropic Motions of Fibrils Dictated by Their Orientations in the Lamella: A Coarse-Grained Model of a Plant Cell Wall S Mani, DJ Cosgrove, GA Voth Journal of Physical Chemistry B, 2020 | 13 | 2020 |
Effect of Chain Flexibility and Interlayer Interactions on the Local Dynamics of Layered Polymer Systems S Mani, R Khare Macromolecules 51 (2), 576-588, 2018 | 13 | 2018 |
Treatment of textile effluent using SBR with pre and post treatments: Kinetics, simulation and optimization of process time for shock loads R Ashwin, KS Athinthra, M Sriramvignesh, MN Kathiravan, KP Gopinath Desalination 275 (1-3), 203-211, 2011 | 12 | 2011 |
Chain and Solvent Dynamics in Polymer Membrane Films Supported on a Polymeric Substrate R Islam, S Mani, R Khare ACS Applied Polymer Materials 3 (6), 3164-3174, 2021 | 4 | 2021 |
Water structure and mobility in acrylamide copolymer glycohydrogels with galactose and siloxane pendant groups AL Fogel, A Ravichandran, S Mani, B Upadhyay, R Khare, SE Morgan Journal of Polymer Science Part B: Polymer Physics 57 (10), 584-597, 2019 | 1 | 2019 |
Rheology of Styrene–Butadiene Rubber: Bridging the Gap between Timescales of Atomistically-Detailed Molecular Simulations and Experiments A Perego, S Mani, F Khabaz ACS Applied Polymer Materials 4 (4), 2314-2322, 2022 | | 2022 |
Multiscale Coarse-Grained Model of Actin Filaments and Its Predictions of Compressive and Tensile Deformations on Filament Composition S Mani, HH Katkar, GA Voth 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
Mechanism of Inorganic Phosphate Release from Actin Subunits S Mani, HH Katkar, GA Voth 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
A Systematic Multiscale Computational Approach for Engineering Novel Adaptive Materials for Biological Applications S Mani 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
Role of Interfacial Interactions and Chain Flexibility in Density and Concentration Fluctuations of Layered Polymer Systems A Ravichandran, S Mani, A Patel, R Khare 2019 AIChE Annual Meeting, 2019 | | 2019 |
A Systematic Multiscale Coarse-Grained Model of Actin Filament Networks S Mani, HH Katkar, GA Voth 2019 AIChE Annual Meeting, 2019 | | 2019 |
Mesoscale Modeling of Plant Cell Walls and Understanding Their Mechanics during Cell Growth S Mani, F Aydin, GA Voth 2018 AIChE Annual Meeting, 2018 | | 2018 |
Effect of Polymer-Polymer Interface on Polymer Chain Dynamics S Mani, R Islam, R Khare APS March Meeting Abstracts 2018, B55. 005, 2018 | | 2018 |
Dynamics of solvent molecules in polyacrylate gels supported on a polymeric substrate R Islam, S Mani, R Khare ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 253, 2017 | | 2017 |
Structure and Dynamics of Thin Polyacrylate Gel Films Supported on a Polymeric Substrate S Mani, R Islam, R Khare APS March Meeting Abstracts 2017, V10. 010, 2017 | | 2017 |
Guidance for the design of pervaporation membranes from molecular simulations and experiments F Khabaz, S Mani, R Godbole, R Hedden, R Khare ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |