Yip Yew Mun's repositories
AutoPLGMX
An automated workflow to run GROMACS simulations for any protein-ligand complex.
Language:Python000
PocketFlow
an autoregressive flow model incorporated with chemical acknowledge for generating drug-like molecules inside protein pockets
Language:Python000
xpm2txt
Updated xpm2txt.py to be compatible with Python 3.10
Language:PythonMIT000