From: Danny Xu (quantum_mania_at_yahoo.com)
Date: Tue Dec 20 2016 - 15:24:36 CST
I have hundreds of PDB files that I need to set up for explicit solvement MD simulations. Is there any way to automate QwikMD, process these PDB files and prepare NAMD input files in batch mode?
This archive was generated by hypermail 2.1.6 : Sun Dec 31 2017 - 23:20:54 CST