Software:nest Documentation
From Honiglab_public
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Using nest:
Usage: nest -seed num -fast num -tune num -log str -opt num -nopt num -out num file.pir
-fast fast mode.from 0-5; default is 3.with 5 fastest
-tune alignment tuning, from 0-3; defautl is 0.
0,no alignment tuning
1,remove gaps in secondary strucutre
2,remove zig-zag gaps plus -tune 1;
3,remove terminal gaps plus -tune 2;
-opt refine mode, from 0-4; default is 1.with 4 thorough refinement
0, no minimization at all;
1, remove atom clashes;
2, refine in insertion and deletion regions, usually loop regions;
3, refine in all loop regions;
4, refine in all loop and secondary regions
-out output mode, from 0-2, defautl is 0. with 2 all intermediate output
0, only final structures written down;
1, intermediate structures also outputted;
2, more intermediate output
-seed set seed number, defautl is 18120.
-nopt number of rounds of refinement.default is 1.
-log log file.default is standard screen output
file.pir pir alignment file
nest is supported by a funding from the National Science Foundation Grant # DBI-9904841
Developed in the Honig Lab
