From: jas theway (jastheway_at_yahoo.com)
Date: Mon Jan 23 2006 - 19:02:13 CST
Hello, all.
I would like to create psf for carbohydrate such as cellutetraose. I got topology file for CSFF. It doesn't seem to work: the new psf and pdb do not look like any glucose units at all. I tried with the following script
package require psfgen
topology CSFF_top.inp
segment A {pdb 1ece_cellutetraose.pdb}
coordpdb 1ece_cellutetraose.pdb A
guesscoord
writepdb new.pdb
writepsf new.psf
exit
Could anyone please tell me the right way to generate psf for carbohydrate?
Please help to modify the script. Thank you.
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