how to use leap2fist or to dump PSF

Yue yueyan... at
Wed Aug 1 23:48:51 UTC 2012


I'm trying to get a PSF file from AMBER topology file and PDB file in order 
to use 'MOLNAME' keyword in CONSTRAINT section for ease. Can anyone tell me 
which keyword I should put into the input file to have CP2K generate a PSF 
file? Or can anyone tell me how to use leap2fist? Thank you!

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