List of works - Mangesh I. Chaudhari

Assessment of Simple Models for Molecular Simulation of Ethylene Carbonate and Propylene Carbonate as Solvents for Electrolyte Solutions.

scientific article published on 12 February 2018

Communication: Direct observation of a hydrophobic bond in loop closure of a capped (-OCH2CH2-)n oligomer in water

scientific article published on 01 December 2010

Comparison of single-ion molecular dynamics in common solvents

scientific article published on 01 June 2018

Computing Potential of the Mean Force Profiles for Ion Permeation Through Channelrhodopsin Chimera, C1C2

scientific article published on 01 January 2021

Concentration dependence of the Flory-Huggins interaction parameter in aqueous solutions of capped PEO chains. ⬇️

scientific article published on December 2014

Correction to Octa-Coordination and the Aqueous Ba(2+) Ion.

scientific article published on 7 August 2015

Dielectric Relaxation of Ethylene Carbonate and Propylene Carbonate from Molecular Dynamics Simulations.

scientific article published on 24 November 2015

Effect of orifice shape in synthetic jet based impingement cooling

Erratum: "Interfaces of propylene carbonate" [J. Chem. Phys. 138, 114708 (2013)]

scientific article published on 01 June 2015

Hydration Mimicry by Membrane Ion Channels

scientific article published on 10 March 2020

Hydration of Kr(aq) in Dilute and Concentrated Solutions

scientific article published on 28 October 2014

Interfaces of propylene carbonate

scientific article published on 01 March 2013

Loop-Closure and Gaussian Models of Collective Structural Characteristics of Capped PEO Oligomers in Water

scientific article published on 21 August 2014

Molecular Dynamics of Lithium Ion Transport in a Model Solid Electrolyte Interphase.

scientific article published on 16 July 2018

Molecular Simulation Results on Charged Carbon Nanotube Forest-Based Supercapacitors

scientific article published on 03 May 2018

Molecular Theory and the Effects of Solute Attractive Forces on Hydrophobic Interactions.

scientific article published on 22 December 2015

Molecular-Scale Description of SPAN80 Desorption from a Squalane-Water Interface

scientific article published on 7 December 2017

Molecular-scale hydrophobic interactions between hard-sphere reference solutes are attractive and endothermic.

scientific article published on 02 December 2013

Nanoporous Hydrogels for the Observation of Anthrax Exotoxin Translocation Dynamics

scientific article published on 04 April 2018

Octa-Coordination and the Aqueous Ba(2+) Ion

scientific article published on 01 July 2015

Probing Translocation in Mutants of the Anthrax Channel: Atomically Detailed Simulations with Milestoning

scientific article published on 05 November 2018

Quasi-Chemical Theory with Cluster Sampling from Ab Initio Molecular Dynamics: Fluoride (F-) Anion Hydration

scientific article published on 14 December 2018

Quasi-chemical theory of F-(aq): The "no split occupancies rule" revisited

scientific article published in October 2017

Role of Solute Attractive Forces in the Atomic-Scale Theory of Hydrophobic Effects

scientific article published on 31 May 2018

Scaling Atomic Partial Charges of Carbonate Solvents for Lithium Ion Solvation and Diffusion

scientific article

Statistical Analyses of Hydrophobic Interactions: A Mini-Review

scientific article published on 3 June 2016

Strontium and barium in aqueous solution and a potassium channel binding site