unatarajan

@article{Kurapati202216500,
title = {Tacticity and Ionization Effects on Adsorption Behavior of Poly(acrylic acid) and Poly(methacrylic acid) at the CCl4-H2O Interface Revealed by MD Simulations},
author = {R Kurapati and U Natarajan},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85142134496&doi=10.1021%2facs.iecr.2c02416&partnerID=40&md5=1fc4921db4b816f3362f88c04cc1a5af},
doi = {10.1021/acs.iecr.2c02416},
issn = {08885885},
year = {2022},
date = {2022-01-01},
journal = {Industrial and Engineering Chemistry Research},
volume = {61},
number = {44},
pages = {16500-16516},
publisher = {American Chemical Society},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Kurapati2022,
title = {New insights into adsorption structure and hydration of polymer at oil-water interface obtained by molecular dynamics simulations: Isotactic poly(methacrylic acid)},
author = {R Kurapati and U Natarajan},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85139408035&doi=10.1016%2fj.polymer.2022.125378&partnerID=40&md5=6cace724c4911e05864fb9f903161c44},
doi = {10.1016/j.polymer.2022.125378},
issn = {00323861},
year = {2022},
date = {2022-01-01},
journal = {Polymer},
volume = {260},
publisher = {Elsevier Ltd},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Yerrayya2022b,
title = {Mechanistic Kinetic Analysis of Fast Pyrolysis of Vanillin to Primary Phenols},
author = {A Yerrayya and U Natarajan and R Vinu},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85134807016&doi=10.3389%2ffenrg.2022.907505&partnerID=40&md5=c08de724d8270a753dd0d463861adfea},
doi = {10.3389/fenrg.2022.907505},
issn = {2296598X},
year = {2022},
date = {2022-01-01},
journal = {Frontiers in Energy Research},
volume = {10},
publisher = {Frontiers Media S.A.},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Kunche2021670,
title = {Structure and dynamics of an aqueous solution containing poly-(acrylic acid) and non-ionic surfactant octaethylene glycoln-decyl ether (C10E8) aggregates and their complexes investigated by molecular dynamics simulations},
author = {L Kunche and U Natarajan},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85100266381&doi=10.1039%2fd0sm01322f&partnerID=40&md5=d73657ce4bd482f527e3d00d24c5db1b},
doi = {10.1039/d0sm01322f},
issn = {1744683X},
year = {2021},
date = {2021-01-01},
journal = {Soft Matter},
volume = {17},
number = {3},
pages = {670-687},
publisher = {Royal Society of Chemistry},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Pachpinde20211299,
title = {Conformations, inter-molecular structure and hydrogen bond dynamics of neutral and cationic poly(vinyl amine) in aqueous solution},
author = {S Pachpinde and U Natarajan},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85114028502&doi=10.1080%2f08927022.2021.1968389&partnerID=40&md5=a89a0892e3c2321084a43676a4d54d39},
doi = {10.1080/08927022.2021.1968389},
issn = {08927022},
year = {2021},
date = {2021-01-01},
journal = {Molecular Simulation},
volume = {47},
number = {16},
pages = {1299-1312},
publisher = {Taylor and Francis Ltd.},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Kunche2021,
title = {Structure and dynamics of aqueous solutions containing poly-(acrylic acid) and non-ionic surfactant pentaethylene glycol n-octyl ether (C8E5): A molecular simulations study},
author = {L Kunche and U Natarajan},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85090421652&doi=10.1016%2fj.commatsci.2020.110043&partnerID=40&md5=ab65013222345a1a6546770654a3dbda},
doi = {10.1016/j.commatsci.2020.110043},
issn = {09270256},
year = {2021},
date = {2021-01-01},
journal = {Computational Materials Science},
volume = {186},
publisher = {Elsevier B.V.},
keywords = {},
pubstate = {published},
tppubtype = {article}
}

@article{Sandilya202025655,
title = {Molecular View into the Cyclodextrin Cavity: Structure and Hydration},
author = {A A Sandilya and U Natarajan and M H Priya},
url = {https://www.scopus.com/inward/record.uri?eid=2-s2.0-85092012224&doi=10.1021%2facsomega.0c02760&partnerID=40&md5=3084a2557ca04a46dccc6b13c2ea4d8d},
doi = {10.1021/acsomega.0c02760},
issn = {24701343},
year = {2020},
date = {2020-01-01},
journal = {ACS Omega},
volume = {5},
number = {40},
pages = {25655-25667},
publisher = {American Chemical Society},
keywords = {},
pubstate = {published},
tppubtype = {article}
}