[gmx-users] how to checkpoint per steps

Du, Yu duyu at sioc.ac.cn
Fri Nov 24 04:03:20 CET 2017

Dear GMX Users, 

In GMX, I can't checkpoint per some MD steps but only checkpoint per wall time period, right?

Du, Yu
PhD Student,
Shanghai Institute of Organic Chemistry
345 Ling Ling Rd., Shanghai, China. 
Zip: 200032, Tel: (86) 021 5492 5275

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