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Journal of Molecular Modeling
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November 20, 2009
Theoretical insights into the trends in molecular properties of HCY, HSiY and HGeY molecules where Y = N, P, As
Fariba Nazari, Narjes Ansari
The Journal of Chemical Physics
|
February 8, 2016
Isotope effects of ground and lowest lying vibrational states of H(3-x)D(x)O2(-) complexes
Narjes Ansari, Hans-Dieter Meyer
The Journal of Physical Chemistry Letters
|
August 31, 2019
Spontaneously Forming Dendritic Voids in Liquid Water Can Host Small Polymers
Narjes Ansari, Alessandro Laio, Ali Hassanali
Physical Chemistry Chemical Physics : PCCP
|
April 25, 2015
Theoretical study of electronic and tribological properties of h-BNC2/graphene, h-BNC2/h-BN and h-BNC2/h-BNC2 bilayers
Narjes Ansari, Fariba Nazari, Francesc Illas
Physical Chemistry Chemical Physics : PCCP
|
September 4, 2014
Line defects and induced doping effects in graphene, hexagonal boron nitride and hybrid BNC
Narjes Ansari, Fariba Nazari, Francesc Illas
Nature Communications
|
September 16, 2022
Water regulates the residence time of Benzamidine in Trypsin
Narjes Ansari, Valerio Rizzi, Michele Parrinello
Journal of Chemical Theory and Computation
|
June 20, 2020
Molecular Mechanism of Gas Solubility in Liquid: Constant Chemical Potential Molecular Dynamics Simulations
Narjes Ansari, Tarak Karmakar, Michele Parrinello
Journal of the American Chemical Society
|
August 16, 2021
Water-Triggered, Irreversible Conformational Change of SARS-CoV-2 Main Protease on Passing from the Solid State to Aqueous Solution
Narjes Ansari, Valerio Rizzi, Paolo Carloni, et al.
Nature Communications
|
January 5, 2021
The role of water in host-guest interaction
Valerio Rizzi, Luigi Bonati, Narjes Ansari, et al.
Journal of Chemical Theory and Computation
|
August 21, 2023
OneOPES, a Combined Enhanced Sampling Method to Rule Them All
Valerio Rizzi, Simone Aureli, Narjes Ansari, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 20) with videos related to
Sort By:
Page
of 2
Journal of Molecular Modeling
|
November 20, 2009
Theoretical insights into the trends in molecular properties of HCY, HSiY and HGeY molecules where Y = N, P, As
Fariba Nazari, Narjes Ansari
The Journal of Chemical Physics
|
February 8, 2016
Isotope effects of ground and lowest lying vibrational states of H(3-x)D(x)O2(-) complexes
Narjes Ansari, Hans-Dieter Meyer
The Journal of Physical Chemistry Letters
|
August 31, 2019
Spontaneously Forming Dendritic Voids in Liquid Water Can Host Small Polymers
Narjes Ansari, Alessandro Laio, Ali Hassanali
Physical Chemistry Chemical Physics : PCCP
|
April 25, 2015
Theoretical study of electronic and tribological properties of h-BNC2/graphene, h-BNC2/h-BN and h-BNC2/h-BNC2 bilayers
Narjes Ansari, Fariba Nazari, Francesc Illas
Physical Chemistry Chemical Physics : PCCP
|
September 4, 2014
Line defects and induced doping effects in graphene, hexagonal boron nitride and hybrid BNC
Narjes Ansari, Fariba Nazari, Francesc Illas
Nature Communications
|
September 16, 2022
Water regulates the residence time of Benzamidine in Trypsin
Narjes Ansari, Valerio Rizzi, Michele Parrinello
Journal of Chemical Theory and Computation
|
June 20, 2020
Molecular Mechanism of Gas Solubility in Liquid: Constant Chemical Potential Molecular Dynamics Simulations
Narjes Ansari, Tarak Karmakar, Michele Parrinello
Journal of the American Chemical Society
|
August 16, 2021
Water-Triggered, Irreversible Conformational Change of SARS-CoV-2 Main Protease on Passing from the Solid State to Aqueous Solution
Narjes Ansari, Valerio Rizzi, Paolo Carloni, et al.
Nature Communications
|
January 5, 2021
The role of water in host-guest interaction
Valerio Rizzi, Luigi Bonati, Narjes Ansari, et al.
Journal of Chemical Theory and Computation
|
August 21, 2023
OneOPES, a Combined Enhanced Sampling Method to Rule Them All
Valerio Rizzi, Simone Aureli, Narjes Ansari, et al.
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of 2