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There are 69309 results for: content related to: Large-scale DFT calculations in implicit solvent—A case study on the T4 lysozyme L99A/M102Q protein

  1. Catalogue of candidate emission-line objects in the Small Magellanic Cloud

    Monthly Notices of the Royal Astronomical Society

    Volume 311, Issue 4, February 2000, Pages: 741–747, M. T. Murphy and M. S. Bessell

    Version of Record online : 4 APR 2002, DOI: 10.1046/j.1365-8711.2000.03160.x

  2. An ATCA radio-continuum study of the Small Magellanic Cloud – V. Long-slit optical spectroscopy of supernova remnants and confirmation of a new candidate supernova remnant

    Monthly Notices of the Royal Astronomical Society

    Volume 376, Issue 4, April 2007, Pages: 1793–1804, J. L. Payne, G. L. White, M. D. Filipović and T. G. Pannuti

    Version of Record online : 16 MAR 2007, DOI: 10.1111/j.1365-2966.2007.11561.x

  3. You have free access to this content
    Energetics of overall metabolic reactions of thermophilic and hyperthermophilic Archaea and Bacteria

    FEMS Microbiology Reviews

    Volume 25, Issue 2, April 2001, Pages: 175–243, Jan P. Amend and Everett L. Shock

    Version of Record online : 9 JAN 2006, DOI: 10.1111/j.1574-6976.2001.tb00576.x

  4. High-resolution H i observations of the Western Magellanic Bridge

    Monthly Notices of the Royal Astronomical Society

    Volume 339, Issue 1, February 2003, Pages: 105–124, E. Muller, L. Staveley-Smith, W. Zealey and S. Stanimirović

    Version of Record online : 31 JAN 2003, DOI: 10.1046/j.1365-8711.2003.06147.x

  5. Ab initio and DFT studies of the thermal rearrangement of trimethylsilyl(methyl)silylene: Remarkable rearrangements of silicon intermediates

    Journal of Computational Chemistry

    Volume 31, Issue 1, 15 January 2010, Pages: 154–163, Bong Hyun Boo, Suk Im and Sungyul Lee

    Version of Record online : 6 MAY 2009, DOI: 10.1002/jcc.21254

  6. Quantum chemical study on ferromagnetic property on the N,N-dimethylaniline dimer radical cation

    International Journal of Quantum Chemistry

    Volume 89, Issue 5, 2002, Pages: 484–488, Zhongmin Su, Yongqing Qiu, Hongmei Zhao, Rongshun Wang, Ruifeng Zhang and Jiacong Shen

    Version of Record online : 24 JUL 2002, DOI: 10.1002/qua.10318

  7. High level ab initio and density functional theory calculations of the dissociation energies, ionization energies, geometrical variations, and vibrational modes of ground and excited CO2, CO2+, and CO22+

    International Journal of Quantum Chemistry

    Volume 86, Issue 6, 2002, Pages: 541–568, Abraham F. Jalbout

    Version of Record online : 5 DEC 2001, DOI: 10.1002/qua.10020

  8. High-mass X-ray binaries in the Small Magellanic Cloud: the luminosity function

    Monthly Notices of the Royal Astronomical Society

    Volume 362, Issue 3, September 2005, Pages: 879–890, P. Shtykovskiy and M. Gilfanov

    Version of Record online : 25 AUG 2005, DOI: 10.1111/j.1365-2966.2005.09320.x

  9. Tautomeric equilibria of 2- and 4-thiouracil in gas phase and in solvent: A density functional study

    International Journal of Quantum Chemistry

    Volume 82, Issue 1, 2001, Pages: 44–52, T. Marino, N. Russo, E. Sicilia and M. Toscano

    Version of Record online : 12 FEB 2001, DOI: 10.1002/1097-461X(2001)82:1<44::AID-QUA1020>3.0.CO;2-6

  10. Energy decomposition scheme for combined ab initio quantum mechanical / molecular mechanical methods

    International Journal of Quantum Chemistry

    Volume 104, Issue 3, 2005, Pages: 328–334, Imre Berente and Gábor Náray-Szabó

    Version of Record online : 11 APR 2005, DOI: 10.1002/qua.20571

  11. Seismological and tectonic setting of the 27 February 2010 offshore Maule, Chile earthquake

    The Structural Design of Tall and Special Buildings

    Volume 19, Issue 8, December 2010, Pages: 838–852, Marshall Lew, Farzad Naeim, Lauren D. Carpenter, Nabih F. Youssef, Fabian Rojas, Macarena Schachter Adaros and G. Rodolfo Saragoni

    Version of Record online : 29 NOV 2010, DOI: 10.1002/tal.677

  12. Paleomagnetism and magnetic fabric of the Eastern Cordillera of Colombia: Evidence for oblique convergence and nonrotational reactivation of a Mesozoic intracontinental rift

    Tectonics

    Volume 33, Issue 11, November 2014, Pages: 2233–2260, Giovanny Jiménez, Fabio Speranza, Claudio Faccenna, German Bayona and Andres Mora

    Version of Record online : 26 NOV 2014, DOI: 10.1002/2014TC003532

  13. Geothermal evidence for fluid flow through the gas hydrate stability field off Central Chile—transient flow related to large subduction zone earthquakes?

    Geophysical Journal International

    Volume 166, Issue 1, July 2006, Pages: 461–468, Ingo Grevemeyer, Norbert Kaul and Juan L. Diaz-Naveas

    Version of Record online : 7 JUN 2006, DOI: 10.1111/j.1365-246X.2006.02940.x

  14. The stable hydrogen and oxygen isotope variation of water stored in polyethylene terephthalate (PET) bottles

    Rapid Communications in Mass Spectrometry

    Volume 22, Issue 5, 15 March 2008, Pages: 672–676, Jorge E. Spangenberg and Torsten W. Vennemann

    Version of Record online : 4 FEB 2008, DOI: 10.1002/rcm.3415

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    Biodiversity co-benefits of reducing emissions from deforestation under alternative reference levels and levels of finance

    Conservation Letters

    Volume 4, Issue 2, April/May 2011, Pages: 101–115, Jonah Busch, Fabiano Godoy, Will R. Turner and Celia A. Harvey

    Version of Record online : 21 OCT 2010, DOI: 10.1111/j.1755-263X.2010.00150.x

  16. The Chandra Small Magellanic Cloud Wing Survey – the search for X-ray binaries

    Monthly Notices of the Royal Astronomical Society

    Volume 383, Issue 1, January 2008, Pages: 330–338, K. E. McGowan, M. J. Coe, M. P. E. Schurch, V. A. McBride, J. L. Galache, W. R. T. Edge, R. H. D. Corbet, S. Laycock and D. A. H. Buckley

    Version of Record online : 7 DEC 2007, DOI: 10.1111/j.1365-2966.2007.12559.x

  17. Theoretical study of hydrogenation of thiouracils and their base pairs with adenine

    International Journal of Quantum Chemistry

    Volume 99, Issue 5, 2004, Pages: 841–853, Leif A. Eriksson, Eugene S. Kryachko and Minh T. Nguyen

    Version of Record online : 29 JAN 2004, DOI: 10.1002/qua.10856

  18. You have free access to this content
    Climate change and Arctic ecosystems: 1. Vegetation changes north of 55°N between the last glacial maximum, mid-Holocene, and present

    Journal of Geophysical Research: Atmospheres (1984–2012)

    Volume 108, Issue D19, 16 October 2003, Nancy H. Bigelow, Linda B. Brubaker, Mary E. Edwards, Sandy P. Harrison, I. Colin Prentice, Patricia M. Anderson, Andrei A. Andreev, Patrick J. Bartlein, Torben R. Christensen, Wolfgang Cramer, Jed O. Kaplan, Anatoly V. Lozhkin, Nadja V. Matveyeva, David F. Murray, A. David McGuire, Volodya Y. Razzhivin, James C. Ritchie, Benjamin Smith, Donald A. Walker, Konrad Gajewski, Victoria Wolf, Björn H. Holmqvist, Yaeko Igarashi, Konstantin Kremenetskii, Aage Paus, Michael F. J. Pisaric and Valentina S. Volkova

    Version of Record online : 8 OCT 2003, DOI: 10.1029/2002JD002558

  19. A 2dF survey of the Small Magellanic Cloud

    Monthly Notices of the Royal Astronomical Society

    Volume 353, Issue 2, September 2004, Pages: 601–623, Christopher J. Evans, Ian D. Howarth, Michael J. Irwin, Adam W. Burnley and Timothy J. Harries

    Version of Record online : 6 AUG 2004, DOI: 10.1111/j.1365-2966.2004.08096.x

  20. Mira kinematics from Hipparcos data: a Galactic bar to beyond the Solar circle

    Monthly Notices of the Royal Astronomical Society

    Volume 317, Issue 2, September 2000, Pages: 460–487, Michael W. Feast and Patricia A. Whitelock

    Version of Record online : 4 APR 2002, DOI: 10.1046/j.1365-8711.2000.03629.x