I. Chandrasekhar

Most-cited papers

1. Biomolecular modeling: Goals, problems, perspectives.

   W. V. van Gunsteren, D. Bakowies, R. Baron, I. Chandrasekhar +12 more

   2006Angewandte Chemie551 citations

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2. A consistent potential energy parameter set for lipids: dipalmitoylphosphatidylcholine as a benchmark of the GROMOS96 45A3 force field

   I. Chandrasekhar, Mika A. Kastenholz, R. Lins, C. Oostenbrink +3 more

   2003European Biophysics Journal177 citations

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3. Interaction of the disaccharide trehalose with a phospholipid bilayer: a molecular dynamics study.

   C. S. Pereira, R. Lins, I. Chandrasekhar, Luiz C. G. Freitas +1 more

   2004Biophysical Journal167 citations Open access

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4. A 500 ps molecular dynamics simulation study of interleukin-1 beta in water. Correlation with nuclear magnetic resonance spectroscopy and crystallography.

   I. Chandrasekhar, G. Clore, A. Szabó, A. Gronenborn +1 more

   1992Journal of Molecular Biology150 citations

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5. Molecular dynamics simulations of phospholipid bilayers: Influence of artificial periodicity, system size, and simulation time.

   A. D. de Vries, I. Chandrasekhar, W. V. van Gunsteren, P. Hünenberger

   2005Journal of Physical Chemistry B58 citations

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6. The Time of Relaxation of Stellar Systems.

   I. Chandrasekhar

   194148 citations

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7. Molecular modelling of saccharide-lipid interactions

   B. Rudolph, I. Chandrasekhar, B. Gaber, M. Nagumo

   199047 citations

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8. A molecular dynamics study of the bee venom melittin in aqueous solution, in methanol, and inserted in a phospholipid bilayer

   A. Glättli, I. Chandrasekhar, W. V. van Gunsteren

   2006European Biophysics Journal44 citations Open access

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9. Stabilization of the bio-membrane by small molecules: interaction of trehalose with the phospholipid bilayer.

   I. Chandrasekhar, B. Gaber

   1988Journal of Biomolecular Structure and Dynamics38 citations

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10. Molecular dynamics simulation of lipid bilayers with GROMOS96: Application of surface tension

    I. Chandrasekhar, Dirk Bakowies, A. Glättli, P. Hünenberger +2 more

    200528 citations

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11. A comparison of the potential energy parameters of aliphatic alkanes: molecular dynamics simulations of triacylglycerols in the alpha phase

    I. Chandrasekhar, W. V. van Gunsteren

    2002European Biophysics Journal27 citations

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12. Biomolekulare Modellierung: Ziele, Probleme, Perspektiven

    W. V. van Gunsteren, Dirk Bakowies, R. Baron, I. Chandrasekhar +12 more

    200624 citations

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13. Molecular Dynamics Simulation of Biomolecular Systems

    W. van Gunsteren, D. Bakowies, R. Bürgi, I. Chandrasekhar +12 more

    2001Chimia (Basel)24 citations Open access

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14. Orientation and conformational preference of leucine-enkephalin at the surface of a hydrated dimyristoylphosphatidylcholine bilayer: NMR and MD simulation.

    I. Chandrasekhar, W. V. van Gunsteren, G. Zandomeneghi, P. Williamson +1 more

    2006Journal of the American Chemical Society18 citations

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15. Simulating the Physiological Phase of Hydrated DPPC Bilayers: The Ester Moiety

    I. Chandrasekhar, C. Oostenbrink, W. V. van Gunsteren

    200415 citations

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16. body.city: siting contemporary culture in India

    I. Chandrasekhar, Peter C. Seel

    200315 citations

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17. Sensitivity of molecular dynamics simulations of lipids to the size of the ester carbon

    I. Chandrasekhar, W. V. van Gunsteren

    200110 citations

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18. A Constraint Algorithm for Maintaining Rigid Bonds in Molecular Dynamics Simulations of Large Molecules.

    S. Lambrakos, J. Boris, E. Oran, I. Chandrasekhar +1 more

    19885 citations

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19. The nomenclature and conformational analysis of lipids and lipid analogues

    I. Chandrasekhar, Viswanathan Sasisekharan

    2004Molecular and Cellular Biochemistry3 citations

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20. Molecular modeling of the phospholipid bilayer.

    B. Gaber, M. Nagumo, William R. Light, I. Chandrasekhar +1 more

    1988Advances in Experimental Medicine and Biology2 citations

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21. A Vectorized Near‐Neighbors Algorithm of Order N for Molecular Dynamics Simulations

    S. Lambrakos, J. Boris, I. Chandrasekhar, B. Gaber

    19861 citations

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22. Lipid conformational nomenclature: a general method.

    I. Chandrasekhar, B. Gaber, M. Nagumo

    1992Journal of Biomolecular Structure and Dynamics0 citations

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