KAPAKAYALA ANJI BABU's repositories
TCL_VMD_scripts
Some of useful tcl scripts to analyse data from VMD
RECYCLEBIN_for_Linux
Recycle bin for Linux terminal written by Anji Babu Kapakayala.
Enhanced_Sampling_Methods_Tutorials
Tutorials of few enhanced sampling methods along with bash script to run the method in a single shot..
Kernel_Density_Compression_Algorithm
A model program for Kernel Density Compression Algorithm
Keys-The_Password_Manager
"Keys " is the tool to manage your passwords locally in your PC/laptop.
Amber_Analysis_Scripts
Amber Analysis scripts
BASH-scripts
Some Useful Bash scripts
CPP_Programs
A collection of few C++ Programs written by me.
Docker_Containers
My Docker containers and Dockerfiles
EasyConsoleTool
A TCL VMD Program for the easy and flexible trajectory analysis.
Gnuplot-Script
Kapakayala Anji Babu , IIT Kanpur, India.
Gromacs-scripts
Gromacs molecular dynamics simulation analysis scripts
Gromacs_Analysis_commands
Gromacs Ananlysis
intro_to_Graphics
This repository contains code for the shaders implemented in the workshop.
MDAnalysis_Scripts
Trajectory Analysis scripts using python & MDAnalysis written by ANJI BABU KAPAKAYALA
ReplicaExchangeWithHybridTempering
Scripts and code for REHT simulation (Paper: "High resolution ensemble description of metamorphic and intrinsically disordered proteins using an efficient hybrid parallel tempering scheme")
Reweighing-TASS-1.1
Reweight TASS based biased simulation from CPMD and PLUMED
Send-Mail-from-Terminal
Kapakayala Anji Babu , IIT Kanpur, India.
Setup-Cronetab
Cronetab
Softwares-to-Install-after-new-OS
Kapakayala Anji Babu , IIT Kanpur, India
TASS_REWEIGHTING_PACKAGE
This project is to develope a generalized reweighting code for TASS and its varients using MODULE based FORTRAN90.