Shikha Nangia, Ph.D. - Publications

Affiliations: 
2006 University of Minnesota, Twin Cities, Minneapolis, MN 
Area:
Theoretical and Computational Chemistry

35 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2019 Rajagopal N, Irudayanathan FJ, Nangia S. Computational Nanoscopy of Tight Junctions at the Blood-Brain Barrier Interface. International Journal of Molecular Sciences. 20. PMID 31717316 DOI: 10.3390/ijms20225583  0.48
2019 Campaña MB, Irudayanathan FJ, Davis TR, McGovern-Gooch KR, Loftus R, Ashkar M, Escoffery N, Navarro M, Sieburg MA, Nangia S, Hougland JL. The ghrelin -acyltransferase structure reveals a catalytic channel for transmembrane hormone acylation. The Journal of Biological Chemistry. PMID 31413115 DOI: 10.1074/jbc.AC119.009749  0.48
2019 Rajagopal N, Irudayanathan FJ, Nangia S. Palmitoylation of Claudin-5 Proteins Influences Their Lipid Domain Affinity and Tight Junctions Assembly at the Blood-Brain Barrier Interface. The Journal of Physical Chemistry. B. PMID 30629442 DOI: 10.1021/acs.jpcb.8b09535  0.48
2018 Scher JA, Bayne MG, Srihari A, Nangia S, Chakraborty A. Development of effective stochastic potential method using random matrix theory for efficient conformational sampling of semiconductor nanoparticles at non-zero temperatures. The Journal of Chemical Physics. 149: 014103. PMID 29981557 DOI: 10.1063/1.5026027  0.52
2018 Irudayanathan FJ, Wang X, Wang N, Willsey SR, Seddon IA, Nangia S. Self-Assembly Simulations of Classic Claudins-insights into the Pore Structure, Selectivity and Higher Order Complexes. The Journal of Physical Chemistry. B. PMID 29869889 DOI: 10.1021/acs.jpcb.8b03842  0.48
2017 Irudayanathan FJ, Wang N, Wang X, Nangia S. Architecture of the paracellular channels formed by claudins of the blood-brain barrier tight junctions. Annals of the New York Academy of Sciences. PMID 28614588 DOI: 10.1111/nyas.13378  0.48
2016 Jiang W, Wang X, Guo D, Luo J, Nangia S. Drug-Specific Design of Telodendrimer Architecture for Effective Doxorubicin Encapsulation. The Journal of Physical Chemistry. B. PMID 27513183 DOI: 10.1021/acs.jpcb.6b06070  0.64
2016 Nangia S, Jasper AW, Miller TF, Truhlar DG. Erratum: "Army ants algorithm for rare event sampling of delocalized nonadiabatic transitions by trajectory surface hopping and the estimation of sampling errors by the bootstrap method" [J. Chem. Phys. 120, 3586 (2004)]. The Journal of Chemical Physics. 144: 139901. PMID 27059592 DOI: 10.1063/1.4944694  0.48
2016 Eldawud R, Reitzig M, Opitz J, Rojansakul Y, Jiang W, Nangia S, Dinu CZ. Combinatorial approaches to evaluate nanodiamond uptake and induced cellular fate. Nanotechnology. 27: 085107. PMID 26820775 DOI: 10.1088/0957-4484/27/8/085107  0.64
2015 Irudayanathan FJ, Trasatti JP, Karande P, Nangia S. Molecular Architecture of the Blood Brain Barrier Tight Junction Proteins-A Synergistic Computational and In Vitro Approach. The Journal of Physical Chemistry. B. PMID 26654362 DOI: 10.1021/acs.jpcb.5b09977  0.64
2015 Ma H, Irudayanathan FJ, Jiang W, Nangia S. Simulating Gram-Negative Bacterial Outer Membrane: A Coarse Grain Model. The Journal of Physical Chemistry. B. PMID 26374325 DOI: 10.1021/acs.jpcb.5b07122  0.64
2015 Irudayanathan FJ, Nangia S. 206 Multiscale simulations to characterize the blood brain barrier tight junctions. Journal of Biomolecular Structure & Dynamics. 33: 138-9. PMID 26103416 DOI: 10.1080/07391102.2015.1038135  0.48
2015 DeSalvo SC, Liu Y, Choudhary GS, Ren D, Nangia S, Sureshkumar R. Signaling factor interactions with polysaccharide aggregates of bacterial biofilms. Langmuir : the Acs Journal of Surfaces and Colloids. 31: 1958-66. PMID 25607640 DOI: 10.1021/la504721b  0.64
2015 Jiang W, Luo J, Nangia S. Multiscale approach to investigate self-assembly of telodendrimer based nanocarriers for anticancer drug delivery. Langmuir : the Acs Journal of Surfaces and Colloids. 31: 4270-80. PMID 25532019 DOI: 10.1021/la503949b  0.64
2014 Elward JM, Irudayanathan FJ, Nangia S, Chakraborty A. Optical Signature of Formation of Protein Corona in the Firefly Luciferase-CdSe Quantum Dot Complex. Journal of Chemical Theory and Computation. 10: 5224-8. PMID 26583205 DOI: 10.1021/ct500681m  0.64
2014 Shi C, Yuan D, Nangia S, Xu G, Lam KS, Luo J. A structure-property relationship study of the well-defined telodendrimers to improve hemocompatibility of nanocarriers for anticancer drug delivery. Langmuir : the Acs Journal of Surfaces and Colloids. 30: 6878-88. PMID 24849780 DOI: 10.1021/la5003513  0.64
2013 Desalvo SC, Liu Y, Nangia S, Sureshkumar R. Probing mechanisms of bacterial infection through molecular dynamics simulations Proceedings of the Ieee Annual Northeast Bioengineering Conference, Nebec. 41-42. DOI: 10.1109/NEBEC.2013.129  0.64
2012 Nangia S, Sureshkumar R. Effects of nanoparticle charge and shape anisotropy on translocation through cell membranes. Langmuir : the Acs Journal of Surfaces and Colloids. 28: 17666-71. PMID 23088323 DOI: 10.1021/la303449d  0.64
2010 Nangia S, Garrison BJ. Role of intrasurface hydrogen bonding on silica dissolution Journal of Physical Chemistry C. 114: 2267-2272. DOI: 10.1021/jp909878b  0.64
2010 Nangia S, Garrison BJ. Theoretical advances in the dissolution studies of mineral-water interfaces Theoretical Chemistry Accounts. 127: 271-284. DOI: 10.1007/s00214-010-0770-2  0.64
2009 Nangia S, Garrison BJ. Advanced Monte Carlo approach to study evolution of quartz surface during the dissolution process. Journal of the American Chemical Society. 131: 9538-46. PMID 19583435 DOI: 10.1021/ja901305y  0.64
2009 Morrow CP, Nangia S, Garrison BJ. Ab initio investigation of dissolution mechanisms in aluminosilicate minerals. The Journal of Physical Chemistry. A. 113: 1343-52. PMID 19159201 DOI: 10.1021/jp8079099  0.64
2009 Nangia S, Garrison BJ. Ab initio study of dissolution and precipitation reactions from the edge, kink, and terrace sites of quartz as a function of pH Molecular Physics. 107: 831-843. DOI: 10.1080/00268970802665621  0.64
2008 Nangia S, Garrison BJ. Reaction rates and dissolution mechanisms of quartz as a function of pH. The Journal of Physical Chemistry. A. 112: 2027-33. PMID 18211036 DOI: 10.1021/jp076243w  0.64
2007 Nangia S, Washton NM, Mueller KT, Kubicki JD, Garrison BJ. Study of a family of 40 hydroxylated β-cristobalite surfaces using empirical potential energy functions Journal of Physical Chemistry C. 111: 5169-5177. DOI: 10.1021/jp0678608  0.64
2006 Nangia S, Truhlar DG. Direct calculation of coupled diabatic potential-energy surfaces for ammonia and mapping of a four-dimensional conical intersection seam. The Journal of Chemical Physics. 124: 124309. PMID 16599676 DOI: 10.1063/1.2168447  0.64
2006 Jasper AW, Nangia S, Zhu C, Truhlar DG. Non-Born-Oppenheimer molecular dynamics. Accounts of Chemical Research. 39: 101-8. PMID 16489729 DOI: 10.1021/ar040206v  0.64
2006 Ganguli AK, Nangia S, Thirumal M, Gai PL. A new form of MgTa 2O 6 obtained by the molten salt method Journal of Chemical Sciences. 118: 37-42. DOI: 10.1007/BF02708763  0.64
2005 Nangia S, Truhlar DG, McGuire MJ, Piecuch P. Can a single-reference approach provide a balanced description of ground and excited states? A comparison of the completely renormalized equation-of-motion coupled-cluster method with multireference quasidegenerate perturbation theory near a conical intersection and along a photodissociation coordinate in ammonia. The Journal of Physical Chemistry. A. 109: 11643-6. PMID 16366611 DOI: 10.1021/jp0556355  0.64
2004 Zhu C, Nangia S, Jasper AW, Truhlar DG. Coherent switching with decay of mixing: an improved treatment of electronic coherence for non-Born-Oppenheimer trajectories. The Journal of Chemical Physics. 121: 7658-70. PMID 15485225 DOI: 10.1063/1.1793991  0.64
2004 Jasper AW, Zhu C, Nangia S, Truhlar DG. Introductory lecture: nonadiabatic effects in chemical dynamics. Faraday Discussions. 127: 1-22. PMID 15471336 DOI: 10.1039/b405601a  0.64
2004 Nangia S, Jasper AW, Miller TF, Truhlar DG. Army ants algorithm for rare event sampling of delocalized nonadiabatic transitions by trajectory surface hopping and the estimation of sampling errors by the bootstrap method. The Journal of Chemical Physics. 120: 3586-97. PMID 15268520 DOI: 10.1063/1.1641019  0.64
1998 Singh RB, Niaz MA, Ghosh S, Beegom R, Agarwal P, Nangia S, Moshiri M, Janus ED. Low fat intake and coronary artery disease in a population with higher prevalence of coronary artery disease: the Indian paradox. Journal of the American College of Nutrition. 17: 342-50. PMID 9710843  0.4
1997 Singh RB, Beegom R, Ghosh S, Niaz MA, Rastogi V, Rastogi SS, Singh NK, Nangia S. Epidemiological study of hypertension and its determinants in an urban population of North India. Journal of Human Hypertension. 11: 679-85. PMID 9400911  0.4
1997 Singh RB, Singh NK, Rastogi SS, Wander GS, Aslam M, Onouchi Z, Kummerow FA, Nangia S. Antioxidant effects of lovastatin and vitamin E on experimental atherosclerosis in rabbits. Cardiovascular Drugs and Therapy / Sponsored by the International Society of Cardiovascular Pharmacotherapy. 11: 575-80. PMID 9358962 DOI: 10.1023/A:1007787721410  0.4
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