This record provides a molecular dynamics trajectory for crystalline aluminum generated via lammps using the input files included in this record (main.in, Al99.eam.alloy). This trajectory is used in o
This archive contains data and code related to "Sublytic gasdermin-D pores captured in atomistic molecular simulations" by Schaefer & Hummer. Included are molecular dynamics parameter files, initi
Data Set Overview The Rosetta (RO) Radio Science (RSI) Data Archive is a timeordered collection of raw and partially processed data collected during the Rosetta Mission to ChurymovGerasimenko. For mor
Set of 772 all-atom trajectories simulated from an unbound (apo) configuration of the human p56 -lck tyrosine kinase SH2 domain with its high-specificity phosphopeptide recognition substrate pYEEI
