https://github.com/delalamo/af2_conformations
Tip revision: d60db86886186e80622deaa91045caccaf4103d3 authored by Diego del Alamo on 17 February 2022, 16:16:20 UTC
Update predict.py
Update predict.py
Tip revision: d60db86
rmsf.in
parm models/pth1r_64128_*_0.pdb
trajin models/pth1r_64128_*_?.pdb
trajin models/pth1r_64128_*_??.pdb
autoimage
rms :44-68,106-170,190-213,233-249,260-286@CA
#strip !:1-111,121-188,198-223,233-266@CA
average crdset trjavg
average average_rmsf.pdb pdb
#createcrd CRD1
run
rms ref trjavg :44-68,106-170,190-213,233-249,260-286@CA
atomicfluct out fluct.dat :44-68,106-170,190-213,233-249,260-286@CA byres
run
