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Journal of Chemical Theory and Computation
|
November 26, 2015
Versatile Object-Oriented Toolkit for Coarse-Graining Applications
Victor Rühle, Christoph Junghans, Alexander Lukyanov, et al.
The Journal of Chemical Physics
|
July 16, 2018
Adaptive resolution molecular dynamics technique: Down to the essential
Christian Krekeler, Animesh Agarwal, Christoph Junghans, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Kirkwood-Buff Coarse-Grained Force Fields for Aqueous Solutions
Pritam Ganguly, Debashish Mukherji, Christoph Junghans, et al.
The Journal of Chemical Physics
|
December 22, 2010
Communication: On the locality of hydrogen bond networks at hydrophobic interfaces
Bradley P Lambeth, Christoph Junghans, Kurt Kremer, et al.
The Journal of Chemical Physics
|
May 9, 2016
C-IBI: Targeting cumulative coordination within an iterative protocol to derive coarse-grained models of (multi-component) complex fluids
Tiago E de Oliveira, Paulo A Netz, Kurt Kremer, et al.
Plos One
|
July 21, 2015
Relative Entropy and Optimization-Driven Coarse-Graining Methods in VOTCA
S Y Mashayak, Mara N Jochum, Konstantin Koschke, et al.
Journal of Chemical Theory and Computation
|
November 9, 2018
Electronic Excitations in Complex Molecular Environments: Many-Body Green's Functions Theory in VOTCA-XTP
Jens Wehner, Lothar Brombacher, Joshua Brown, et al.
Scientific Reports
|
August 10, 2020
Modeling and scale-bridging using machine learning: nanoconfinement effects in porous media
Nicholas Lubbers, Animesh Agarwal, Yu Chen, et al.
Scientific Reports
|
September 27, 2023
Predictive scale-bridging simulations through active learning
Satish Karra, Mohamed Mehana, Nicholas Lubbers, et al.
Page
of 2
Search research articles
Search
Showing results (11-20 of 19) with videos related to
Sort By:
Page
of 2
You have reached the last page of results.
This site can display upto 19 results.
Journal of Chemical Theory and Computation
|
November 26, 2015
Versatile Object-Oriented Toolkit for Coarse-Graining Applications
Victor Rühle, Christoph Junghans, Alexander Lukyanov, et al.
The Journal of Chemical Physics
|
July 16, 2018
Adaptive resolution molecular dynamics technique: Down to the essential
Christian Krekeler, Animesh Agarwal, Christoph Junghans, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Kirkwood-Buff Coarse-Grained Force Fields for Aqueous Solutions
Pritam Ganguly, Debashish Mukherji, Christoph Junghans, et al.
The Journal of Chemical Physics
|
December 22, 2010
Communication: On the locality of hydrogen bond networks at hydrophobic interfaces
Bradley P Lambeth, Christoph Junghans, Kurt Kremer, et al.
The Journal of Chemical Physics
|
May 9, 2016
C-IBI: Targeting cumulative coordination within an iterative protocol to derive coarse-grained models of (multi-component) complex fluids
Tiago E de Oliveira, Paulo A Netz, Kurt Kremer, et al.
Plos One
|
July 21, 2015
Relative Entropy and Optimization-Driven Coarse-Graining Methods in VOTCA
S Y Mashayak, Mara N Jochum, Konstantin Koschke, et al.
Journal of Chemical Theory and Computation
|
November 9, 2018
Electronic Excitations in Complex Molecular Environments: Many-Body Green's Functions Theory in VOTCA-XTP
Jens Wehner, Lothar Brombacher, Joshua Brown, et al.
Scientific Reports
|
August 10, 2020
Modeling and scale-bridging using machine learning: nanoconfinement effects in porous media
Nicholas Lubbers, Animesh Agarwal, Yu Chen, et al.
Scientific Reports
|
September 27, 2023
Predictive scale-bridging simulations through active learning
Satish Karra, Mohamed Mehana, Nicholas Lubbers, et al.
Page
of 2