Polydots, soft nanoparticles, at membrane interfaces

por Wijesinghe, Sidath, Junghans, Christoph, Perahia, Dvora, Grest, Gary S.
Publicado 2023

Relative Entropy and Optimization-Driven Coarse-Graining Methods in VOTCA

por Mashayak, S. Y., Jochum, Mara N., Koschke, Konstantin, Aluru, N. R., Rühle, Victor, Junghans, Christoph
Publicado 2015

Electronic Excitations in Complex Molecular Environments: Many-Body Green’s Functions Theory in VOTCA-XTP

por Wehner, Jens, Brombacher, Lothar, Brown, Joshua, Junghans, Christoph, Çaylak, Onur, Khalak, Yuriy, Madhikar, Pranav, Tirimbò, Gianluca, Baumeier, Björn
Publicado 2018

Modeling and scale-bridging using machine learning: nanoconfinement effects in porous media

por Lubbers, Nicholas, Agarwal, Animesh, Chen, Yu, Son, Soyoun, Mehana, Mohamed, Kang, Qinjun, Karra, Satish, Junghans, Christoph, Germann, Timothy C., Viswanathan, Hari S.
Publicado 2020

Predictive scale-bridging simulations through active learning

por Karra, Satish, Mehana, Mohamed, Lubbers, Nicholas, Chen, Yu, Diaw, Abdourahmane, Santos, Javier E., Pachalieva, Aleksandra, Pavel, Robert S., Haack, Jeffrey R., McKerns, Michael, Junghans, Christoph, Kang, Qinjun, Livescu, Daniel, Germann, Timothy C., Viswanathan, Hari S.
Publicado 2023