Search research articles
Contact Us
Filters
Showing results (131-140 of 310) with videos related to
Page
of 31
Sort By:
The Journal of Physical Chemistry. A
|
February 11, 2009
Hydration of sodium(I) and potassium(I) revisited: a comparative QM/MM and QMCF MD simulation study of weakly hydrated ions
S Sikander Azam, Thomas S Hofer, Bernhard R Randolf, et al.
The Journal of Chemical Physics
|
August 20, 2005
An extended ab initio QM/MM MD approach to structure and dynamics of Zn(II) in aqueous solution
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Digital Discovery
|
September 12, 2025
Coupling causality and interpretable machine learning to reveal the reaction coordinate of C-N coupling with a supramolecular Cu-calix[8]arene catalyst
R A Talmazan, J Gamper, I Castillo, et al.
Journal of the American Chemical Society
|
October 13, 2005
Structure and dynamics of solvated Sn(II) in aqueous solution: an ab initio QM/MM MD approach
Thomas S Hofer, Andreas B Pribil, Bernhard R Randolf, et al.
Journal of Computational Chemistry
|
October 16, 2010
Structure and dynamics of methanol in water: a quantum mechanical charge field molecular dynamics study
Syed Tarique Moin, Thomas S Hofer, Bernhard R Randolf, et al.
The Journal of Physical Chemistry. B
|
February 14, 2006
Temperature effects on the structural and dynamical properties of the Zn(II)-water complex in aqueous solution: a QM/MM molecular dynamics study
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Clinical Infectious Diseases : an Official Publication of the Infectious Diseases Society of America
|
October 1, 1995
Nitric oxide and infection: another view
G Schoedon, M Schneemann, R Walter, et al.
Parasitology
|
March 22, 2000
High prevalence of Echinococcus multilocularis in urban red foxes (Vulpes vulpes) and voles (Arvicola terrestris) in the city of Zürich, Switzerland
S Hofer, S Gloor, U Müller, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 25, 2006
Structure and dynamics of the [Zn(NH3)(H2O)5]2+ complex in aqueous solution obtained by an ab initio QM/MM molecular dynamics study
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Journal of Computational Chemistry
|
March 8, 2007
Quantum mechanical charge field molecular dynamics simulation of the TiO2+ ion in aqueous solution
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Page
of 31
Search research articles
Search
Showing results (131-140 of 310) with videos related to
Sort By:
Page
of 31
The Journal of Physical Chemistry. A
|
February 11, 2009
Hydration of sodium(I) and potassium(I) revisited: a comparative QM/MM and QMCF MD simulation study of weakly hydrated ions
S Sikander Azam, Thomas S Hofer, Bernhard R Randolf, et al.
The Journal of Chemical Physics
|
August 20, 2005
An extended ab initio QM/MM MD approach to structure and dynamics of Zn(II) in aqueous solution
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Digital Discovery
|
September 12, 2025
Coupling causality and interpretable machine learning to reveal the reaction coordinate of C-N coupling with a supramolecular Cu-calix[8]arene catalyst
R A Talmazan, J Gamper, I Castillo, et al.
Journal of the American Chemical Society
|
October 13, 2005
Structure and dynamics of solvated Sn(II) in aqueous solution: an ab initio QM/MM MD approach
Thomas S Hofer, Andreas B Pribil, Bernhard R Randolf, et al.
Journal of Computational Chemistry
|
October 16, 2010
Structure and dynamics of methanol in water: a quantum mechanical charge field molecular dynamics study
Syed Tarique Moin, Thomas S Hofer, Bernhard R Randolf, et al.
The Journal of Physical Chemistry. B
|
February 14, 2006
Temperature effects on the structural and dynamical properties of the Zn(II)-water complex in aqueous solution: a QM/MM molecular dynamics study
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Clinical Infectious Diseases : an Official Publication of the Infectious Diseases Society of America
|
October 1, 1995
Nitric oxide and infection: another view
G Schoedon, M Schneemann, R Walter, et al.
Parasitology
|
March 22, 2000
High prevalence of Echinococcus multilocularis in urban red foxes (Vulpes vulpes) and voles (Arvicola terrestris) in the city of Zürich, Switzerland
S Hofer, S Gloor, U Müller, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 25, 2006
Structure and dynamics of the [Zn(NH3)(H2O)5]2+ complex in aqueous solution obtained by an ab initio QM/MM molecular dynamics study
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Journal of Computational Chemistry
|
March 8, 2007
Quantum mechanical charge field molecular dynamics simulation of the TiO2+ ion in aqueous solution
M Qaiser Fatmi, Thomas S Hofer, Bernhard R Randolf, et al.
Page
of 31