Shubhangi1397

Pinned Repositories

• CHAPERONg

  CHAPERONg: An automated pipeline for GROMACS MD simulations and trajectory analyses

  Language:Shell29323

• MDRestraintsGenerator

  Python code for generating Boresch restraints from MD simulations

  Language:Python174235

• gmx_MMPBSA

  gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.

  Language:Python207946564

Shubhangi1397's Repositories