General information: ============= Analysis and comparison of FFEA with all-atom molecular dynamics Solernou, Albert and Hanson, Benjamin S. and Richardson, Robin A and Welch, Robert and Harris, Sarah A. and Read, Daniel J. and Harlen, Oliver G. (2017) File formats: ============= Binary files ------------ * .png - images in Portable Network Graphics format. * .pcz - pyPCA compressed format. * .map - CCP4 electron density map file from the EMDB. * .pdf - figures in Portable Document Format. * .mp4 - h264 video files with mp4 container. Text files ---------- * .pdb - Protein Data Bank files. * .vol - NETGEN 4 tetrahedra mesh file. * .obj - Wavefront .obj geometry data file. * .o* - Log file. * .e* - Log file. * .sh - Shell script for runnning the simulation/ * .stl - 3D mesh file format. * comp.txt - PCA dot product matrix file generated by PyPCA FFEA 2.4 input files * .ffea - input script. * .top - topology file. * .mat - material file. * .node - node file. * .surf - surface file. * .stokes - stokes file. * .lj - lennard-jones file. * .vdw - van der Waals file. * .pin - pin node file. FFEA 2.4 output files * .ftj - trajectory file. * .fm - measurement file. * .fcp - checkpoint file. * .map - FFEA kinetic conformation mapping file (sparse) FFEA is free software that can be found in: https://bitbucket.org/ffea/ffea and documentation hosted at: https://ffea.readthedocs.io