Salt Induced Transitions in Structural Ensemble of Intrinsically Disordered Proteins

Simulation data and the corrosponding analysis script for the work "<strong>Salt Induced Transitions in Conformational Ensemble of Intrinsically Disordered Proteins</strong> " by <em>Hiranmay Maity, Lipika Baidya </em>and<em> Govardhan reddy</em> are deposited here. Analysis Scripts: The scripts for analysing the simulation data are in analysis_script.zip. The folder contains: autocorrelation.c : code for calculating end_to_end distance autocorrelation function with time in C. average_property.cpp: code for calculating average property such as radius of gyration (R_g) from trajectory files in C++. calculate_saxs_kratky.c: code for calculating scattering profile (SAXS and Kratky) from simulation data in C. compute_contact_map.cpp: code for calculating contact map in C. probablity_distribution.c: code for calculating probablity distribution of Rg in C. structure_factor.c: code for calculating structure factor in C.