taseef/BENDER-MPIPI

BENDER-MPIPI Companion dataset to BENDER. Contains coarse-grained molecular dynamics trajectory data from MPIPI (Multi-scale Platform for Intrinsically disordered Protein Interactions) simulations of intrinsically disordered proteins (IDPs). Contents Trajectories are organized by taxonomic kingdom. Each zip file contains subdirectories named by UniProt ID, with the following files per protein: traj.xtc — trajectory file log.lammps — LAMMPS simulation log Rg.out —… See the full description on the dataset page: https://huggingface.co/datasets/taseef/BENDER-MPIPI.