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There are 60232 results for: content related to: New Applications of Computers in Chemistry

  1. Computer-Assisted Solution of Chemical Problems—The Historical Development and the Present State of the Art of a New Discipline of Chemistry

    Angewandte Chemie International Edition in English

    Volume 32, Issue 2, February 1993, Pages: 201–227, Prof. Dr. Ivar Ugi, Dr. Johannes Bauer, Dr. Klemens Bley, Dr. Alf Dengler, Dipl.-Chem. Andreas Dietz, Dr. Eric Fontain, Dr. Bernhard Gruber, Dr. Rainer Herges, Dr. Michael Knauer, Dipl.-Chem. Klaus Reitsam and Dipl.-Chem. Natalie Stein

    Article first published online : 22 DEC 2003, DOI: 10.1002/anie.199302011

  2. Neue Anwendungsgebiete für Computer in der Chemie

    Angewandte Chemie

    Volume 91, Issue 2, Februar 1979, Pages: 99–111, Prof. Dr. Ivar Ugi, Dipl.-Inform. Johannes Bauer, Dr. Josef Brandt, Dipl.-Inform. Josef Friedrich, Dr. Johann Gasteiger, Dr. Clemens Jochum and Dr. Wolfgang Schubert

    Article first published online : 27 JAN 2006, DOI: 10.1002/ange.19790910204

  3. A regional embedding method

    International Journal of Quantum Chemistry

    Volume 44, Issue 6, 5 December 1992, Pages: 997–1013, P. F. Zou

    Article first published online : 19 OCT 2004, DOI: 10.1002/qua.560440605

  4. The Principle of Minimum Chemical Distance (PMCD)

    Angewandte Chemie International Edition in English

    Volume 19, Issue 7, July 1980, Pages: 495–505, Dr. Clemens Jochum, Dr. Johann Gasteiger and Prof. Dr. Ivar Ugi

    Article first published online : 22 DEC 2003, DOI: 10.1002/anie.198004953

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    Accurate cross sections for excitation of resonance transitions in atomic oxygen

    Journal of Geophysical Research: Space Physics (1978–2012)

    Volume 109, Issue A8, August 2004, S. S. Tayal

    Article first published online : 3 AUG 2004, DOI: 10.1029/2004JA010389

  6. The R matrix: Its relation to titchmarsh–Weyl theory and its complex rotated analogue

    International Journal of Quantum Chemistry

    Volume 30, Issue S20, 10/15 March 1986, Pages: 73–80, Nils Elander, Peter Krylstedt, Erkki Brändas and Erik Engdahl

    Article first published online : 19 OCT 2004, DOI: 10.1002/qua.560300710

  7. Soft X-ray emission lines of Fe VII–Fe XVI in stellar coronae in the range 49–106 Å

    Monthly Notices of the Royal Astronomical Society

    Volume 405, Issue 3, July 2010, Pages: 1987–2000, G. Y. Liang and G. Zhao

    Article first published online : 16 APR 2010, DOI: 10.1111/j.1365-2966.2010.16593.x

  8. Die computerunterstützte Lösung chemischer Probleme eine neue Disziplin der Chemie

    Angewandte Chemie

    Volume 105, Issue 2, Februar 1993, Pages: 210–239, Prof. Dr. Ivar Ugi, Dr. Johannes Bauer, Dr. Klemens Bley, Dr. Alf Dengler, Andreas Dietz, Dr. Eric Fontain, Dr. Bernhard Gruber, Dr. Rainer Herges, Dr. Michael Knauer, Klaus Reitsam and Natalie Stein

    Article first published online : 13 JAN 2006, DOI: 10.1002/ange.19931050207

  9. An algorithm for R matrix calculations for atom–diatom reactive scattering

    International Journal of Quantum Chemistry

    Volume 35, Issue 6, June 1989, Pages: 801–811, Jan Linderberg

    Article first published online : 19 OCT 2004, DOI: 10.1002/qua.560350616

  10. Effective collision strengths for electron-impact excitation of transitions within the ground 1s2 2s2 2p4 manifold of O-like Fe18+

    International Journal of Quantum Chemistry

    Volume 109, Issue 9, 2009, Pages: 1920–1927, Juan A. Santana and Yasuyuki Ishikawa

    Article first published online : 12 MAR 2009, DOI: 10.1002/qua.22023

  11. Population structure of the classic period Maya

    American Journal of Physical Anthropology

    Volume 132, Issue 3, March 2007, Pages: 367–380, Andrew K. Scherer

    Article first published online : 4 JAN 2007, DOI: 10.1002/ajpa.20535

  12. Matter Preserving Synthetic Pathways and Semi-Empirical Computer Assisted Planning of Syntheses

    Angewandte Chemie International Edition in English

    Volume 10, Issue 12, December 1971, Pages: 915–919, Prof. Dr. Ivar Ugi and Dr. Paul Gillespie

    Article first published online : 22 DEC 2003, DOI: 10.1002/anie.197109151

  13. Accounting for correlated error in the assimilation of high-resolution sounder data

    Quarterly Journal of the Royal Meteorological Society

    P. P. Weston, W. Bell and J. R. Eyre

    Article first published online : 21 MAR 2014, DOI: 10.1002/qj.2306

  14. The Application of Neumann Type Systems for Solving Integrable Nonlinear Evolution Equations

    Studies in Applied Mathematics

    Volume 127, Issue 2, August 2011, Pages: 153–190, Jinbing Chen

    Article first published online : 28 FEB 2011, DOI: 10.1111/j.1467-9590.2011.00516.x

  15. Continuum states of the hydrogen molecule with the R-Matrix method

    International Journal of Quantum Chemistry

    Volume 29, Issue 5, May 1986, Pages: 1033–1042, Jonathan Tennyson, C. J. Noble and P. G. Burke

    Article first published online : 19 OCT 2004, DOI: 10.1002/qua.560290502

  16. R-matrix quantum defects of molecular hydrogen

    International Journal of Quantum Chemistry

    Volume 104, Issue 4, 5 September 2005, Pages: 530–537, M. Telmini, S. Bezzaouia and Ch. Jungen

    Article first published online : 10 MAY 2005, DOI: 10.1002/qua.20639

  17. Electron Scattering by Atoms, Ions, and Molecules

    Standard Article

    Encyclopedia of Applied Physics

    Klaus Bartschat, Philip G. Burke and Albert Crowe

    Published Online : 15 DEC 2009, DOI: 10.1002/3527600434.eap118.pub2

  18. Nonmetric cranial variation of Jomon Japan: Implications for the evolution of eastern Asian diversity

    American Journal of Human Biology

    Volume 22, Issue 6, November/December 2010, Pages: 782–790, Atsushi Nakashima, Hajime Ishida, Masahito Shigematsu, Masaaki Goto and Tsunehiko Hanihara

    Article first published online : 18 AUG 2010, DOI: 10.1002/ajhb.21083

  19. The mean measure of divergence: Its utility in model-free and model-bound analyses relative to the Mahalanobis D2 distance for nonmetric traits

    American Journal of Human Biology

    Volume 22, Issue 3, May/June 2010, Pages: 378–395, Joel D. Irish

    Article first published online : 13 NOV 2009, DOI: 10.1002/ajhb.21010

  20. CHEMISTRY, A FINITE METRIC TOPOLOGY—SYNTHETIC PLANNING, AN EXERCISE IN ALGEBRA

    Transactions of the New York Academy of Sciences

    Volume 34, Issue 5 Series II, May 1972, Pages: 416–432, Ivar Ugi, Paul Gillespie and Carol Gillespie

    Article first published online : 30 APR 2012, DOI: 10.1111/j.2164-0947.1972.tb02695.x