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Journal of the American Chemical Society|September 30, 2004
Unusual Ar-H/Rh-H J(HH) NMR coupling in complexes of rhodium(III): experimental evidence and theoretical support for an eta1-arene structureJennifer R Krumper, Michael Gerisch, Alessandra Magistrato, et al.
Journal of Chemical Theory and Computation|November 21, 2015
Wagging the Tail: Essential Role of Substrate Flexibility in FAAH CatalysisGiulia Palermo, Pablo Campomanes, Marilisa Neri, et al.
The Journal of Physical Chemistry. B|December 7, 2007
Predicting noncovalent interactions between aromatic biomolecules with London-dispersion-corrected DFTI-Chun Lin, O Anatole von Lilienfeld, Maurício D Coutinho-Neto, et al.
Physical Chemistry Chemical Physics : PCCP|May 31, 2012
Simulations of X-ray absorption spectra: the effect of the solventThomas J Penfold, Basile F E Curchod, Ivano Tavernelli, et al.
Biochemistry|January 28, 2012
Directed evolution of the suicide protein O⁶-alkylguanine-DNA alkyltransferase for increased reactivity results in an alkylated protein with exceptional stabilityBirgit Mollwitz, Elizabeth Brunk, Simone Schmitt, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|June 29, 2010
Reactions of alkynes with [RuCl(cyclopentadienyl)] complexes: the important first stepsBarnali Dutta, Basile F E Curchod, Pablo Campomanes, et al.
Biophysical Chemistry|June 2, 2006
Polarization effects and charge transfer in the KcsA potassium channelDenis Bucher, Simone Raugei, Leonardo Guidoni, et al.
Chimia|December 2, 2014
Lessons from nature: computational design of biomimetic compounds and processesEsra Bozkurt, Negar Ashari, Nicholas Browning, et al.
Structural Dynamics (Melville, N.Y.)|January 30, 2018
Ultrafast dynamics induced by the interaction of molecules with electromagnetic fields: Several quantum, semiclassical, and classical approachesSergey V Antipov, Swarnendu Bhattacharyya, Krystel El Hage, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|August 28, 2020
Multidisciplinary Preclinical Investigations on Three Oxamniquine Analogues as New Drug Candidates for Schistosomiasis*Valentin Buchter, Yih Ching Ong, François Mouvet, et al.
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