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Elfi Kraka

Showing results (1-10 of 130) with videos related to

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The Journal of Physical Chemistry. A|March 6, 2015
Preface: 25th Austin Symposium on Molecular Structure and DynamicsDieter Cremer, Elfi Kraka
Accounts of Chemical Research|March 18, 2010
Computational analysis of the mechanism of chemical reactions in terms of reaction phases: hidden intermediates and hidden transition StatesElfi Kraka, Dieter Cremer
Journal of Computational Chemistry|January 3, 2025
A Closer Look at the FeS Heme Bonds in Azotobacter vinelandii Bacterioferritin: QM/MM and Local Mode AnalysisMarek Freindorf, Elfi Kraka
Physical Chemistry Chemical Physics : PCCP|June 27, 2019
A new way of studying chemical reactions: a hand-in-hand URVA and QTAIM approachSadisha Nanayakkara, Elfi Kraka
International Journal of Molecular Sciences|March 28, 2009
Bonding in mercury-alkali molecules: Orbital-driven van der Waals complexesElfi Kraka, Dieter Cremer
Dalton Transactions (Cambridge, England : 2003)|March 29, 2017
Generalization of the Tolman electronic parameter: the metal-ligand electronic parameter and the intrinsic strength of the metal-ligand bondDieter Cremer, Elfi Kraka
Dalton Transactions (Cambridge, England : 2003)|February 3, 2025
Metal-ligand and hydrogen bonding in the active site of Fe(III)-, Mn(III)- and Co(III)-myoglobinsMarek Freindorf, Elfi Kraka
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|January 20, 2009
Characterization of CF bonds with multiple-bond character: bond lengths, stretching force constants, and bond dissociation energiesElfi Kraka, Dieter Cremer
Journal of Molecular Modeling|September 24, 2020
Critical assessment of the FeC and CO bond strength in carboxymyoglobin: a QM/MM local vibrational mode studyMarek Freindorf, Elfi Kraka
Journal of Computational Chemistry|November 18, 2025
Strength of FeS Bonds and Hydrogen Bonds in Small Molecule Inhibitors of Bacterioferritin: QM/MM and Local Mode AnalysisMarek Freindorf, Elfi Kraka
Pageof 13

Showing results (1-10 of 130) with videos related to

Sort By:
Pageof 13
The Journal of Physical Chemistry. A|March 6, 2015
Preface: 25th Austin Symposium on Molecular Structure and DynamicsDieter Cremer, Elfi Kraka
Accounts of Chemical Research|March 18, 2010
Computational analysis of the mechanism of chemical reactions in terms of reaction phases: hidden intermediates and hidden transition StatesElfi Kraka, Dieter Cremer
Journal of Computational Chemistry|January 3, 2025
A Closer Look at the FeS Heme Bonds in Azotobacter vinelandii Bacterioferritin: QM/MM and Local Mode AnalysisMarek Freindorf, Elfi Kraka
Physical Chemistry Chemical Physics : PCCP|June 27, 2019
A new way of studying chemical reactions: a hand-in-hand URVA and QTAIM approachSadisha Nanayakkara, Elfi Kraka
International Journal of Molecular Sciences|March 28, 2009
Bonding in mercury-alkali molecules: Orbital-driven van der Waals complexesElfi Kraka, Dieter Cremer
Dalton Transactions (Cambridge, England : 2003)|March 29, 2017
Generalization of the Tolman electronic parameter: the metal-ligand electronic parameter and the intrinsic strength of the metal-ligand bondDieter Cremer, Elfi Kraka
Dalton Transactions (Cambridge, England : 2003)|February 3, 2025
Metal-ligand and hydrogen bonding in the active site of Fe(III)-, Mn(III)- and Co(III)-myoglobinsMarek Freindorf, Elfi Kraka
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|January 20, 2009
Characterization of CF bonds with multiple-bond character: bond lengths, stretching force constants, and bond dissociation energiesElfi Kraka, Dieter Cremer
Journal of Molecular Modeling|September 24, 2020
Critical assessment of the FeC and CO bond strength in carboxymyoglobin: a QM/MM local vibrational mode studyMarek Freindorf, Elfi Kraka
Journal of Computational Chemistry|November 18, 2025
Strength of FeS Bonds and Hydrogen Bonds in Small Molecule Inhibitors of Bacterioferritin: QM/MM and Local Mode AnalysisMarek Freindorf, Elfi Kraka
Pageof 13