Hi,
I wonder how much of an impact should there be on structure refinement,
validation and, last but not least, molecular modeling, if we take into
account the recent (2011) re-definition of the hydrogen bond made by the
IUPAC.
Ref:
"Elangannan Arunan, Gautam R. Desiraju, Roger A. Klein,
Joanna Sadlej, Steve Scheiner, Ibon Alkorta, David C. Clary,
Robert H. Crabtree, Joseph J. Dannenberg, Pavel Hobza,
Henrik G. Kjaergaard, Anthony C. Legon, Benedetta Mennucci,
and David J. Nesbitt
Pure Appl. Chem., Vol. 83, No. 8, pp. 1619–1636, 2011.
doi:10.1351/PAC-REP-10-01-01
© 2011 IUPAC, Publication date (Web): 8 July 2011
Defining the hydrogen bond: An account (IUPAC Technical Report)*"
Thanks for your input and interest.
Greetings,
Nadir Mrabet
--
Pr. Nadir T. Mrabet
Structural & Molecular Biochemistry
N-gere - INSERM U-954
University of Lorraine, Nancy
School of Sciences and Technologies
& School of Medicine
9, Avenue de la Foret de Haye, BP 184
54505 Vandoeuvre-les-Nancy Cedex
France
Phone: +33 (0)3.83.68.32.73
Fax: +33 (0)3.83.68.32.79
E-mail: Nadir.Mrabet <at> univ-lorraine.fr
