CCL: Summary: Hydrogen bond
<responce 1>
Dear Masao Masamura
There is a good collection compiled by S. Scheiner in a book published by
Oxford University Press, 1997. The title is "Hydrogen Bonding, A
Theoretical
Perspective".
--
Emad
*********************************************************************
E. Tajkhorshid
German Cancer Research Center; DKFZ Tel: +49 6221 42 2340
Dept. Molecular Biophysics (H0200) FAX: +49 6221 42 2333
P.O.Box 101949
69009 Heidelberg, Germany Email: E.Tajkhorshid at.at DKFZ-Heidelberg.de
*********************************************************************
* "Never express yourself more clearly than you think." -Niels Bohr *
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<responce 2>
From: "rv" <rv at.at MARVIN.tufts.edu>
Date: Tue, 28 Jul 1998 16:34:22 -0700
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To: ep7 at.at dent.okayama-u.ac.jp
Subject: Re: CCL:Hydrogen bond
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Hydrogen Bonding in Biological Structures by Jeffrey and Saenger, Springer
Verlag, 1994 is a good reference and a good starting point for hydrogen bond
metrology and comparison of experimental and theoretical methods for H-bond
determination.
Regina Valluzzi
Tufts Biotechnology Center
--
rv
<responce 3>
From: PUDZIANA at.at watson.bms.com
Date: Wed, 29 Jul 1998 10:52:12 -0500 (EST)
Subject: Re: CCL:Hydrogen bond
To: ep7 <ep7 at.at dent.okayama-u.ac.jp>
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Masao -
Because I'm very familiar with my own work(!!) let me mention the
following articles: A. T. Pudzianowski, "Current computational approaches
to the strong hydrogen bond," Recent Research Developments in Physical
Chemistry 1 (1997), 81-97; A. T. Pudzianowski, "A Systematic Appraisal of
Density Functional From: PUDZIANA at.at watson.bms.com
Date: Wed, 29 Jul 1998 10:52:12 -0500 (EST)
Subject: Re: CCL:Hydrogen bond
To: ep7 <ep7 at.at dent.okayama-u.ac.jp>
Content-transfer-encoding: 7BIT
X-UIDL: 236f67f4dfb0761f01b6b100673b8000
Masao -
Because I'm very familiar with my own work(!!) let me mention the
following articles: A. T. Pudzianowski, "Current computational approaches
to the strong hydrogen bond," Recent Research Developments in Physical
Chemistry 1 (1997), 81-97; A. T. Pudzianowski, "A Systematic Appraisal of
Density Functional Methodologies for Hydrogen Bonding in Binary Ionic
Complexes," J. Phys. Chem. 100, (1996), 4781-4789; A. T. Pudzianowski,
"MP2/6-311++G(d,p) study of ten ionic hydrogen-bonded binary systems:
Structures, normal modes, thermodynamics, and counterpoise energies,"
J. Chem. Phys. 102 (1995), 8029-8039; A. T. Pudzianowski, "Comment on
'The protonated water dimer: Extensive theoretical studies of H5O2+,'
[J. Chem. Phys. 101, 4878 (1994)]," J. Chem. Phys. 102 (1995), 7761.
These papers also have extensive references to theoretical, computa-
tional, and experimental work published prior to 1996, so they should
still be useful.
Cheers,
Andrew Pudzianowski
Masao Masamura
Preventive Dentistry
Okayama University Dental School
Shikata-cho, 2-5-1
Okayama 700
Japan
FAX: 81-86-235-6714
e-mail: ep7 at.at dent.okayama-u.ac.jp