Examples for QM/MM MD simulations using CHARMM-TURBOMOLE
greatlse/charmm-turbomole-examples
Example input files for CHARMM-TURBOMOLE QM/MM MD simulations.
Python
Example input files for CHARMM-TURBOMOLE QM/MM MD simulations.
Python
Examples for QM/MM MD simulations using CHARMM-TURBOMOLE