- Posts: 8
Insane explote my protein .-
- bqAlvii
- Topic Author
- Offline
- Fresh Boarder
Less
More
1 year 6 months ago #9521
by bqAlvii
Insane explote my protein .- was created by bqAlvii
Hi everyone.
Im trying to build one structure with these 2 scripts = Martinize and Insane.
I could create my cg protein model with martinize so i believed worst part was gone. The real problem appears when im trying to build any membrane structure along with my cg structure. In facts, Insane create my structure (membrane & protein) but, its wrong angle oriented.
So, i decide to useto re-orient my protein across the membrane. The problem happen here, my protein explodes and lose its conformation, forming a bunch of dots with any sences.
Protein Alone
Protein + Membrane wrong oriented
Protein + Membrane oriented and explode
This is the command i use in insane=
Im trying to build one structure with these 2 scripts = Martinize and Insane.
I could create my cg protein model with martinize so i believed worst part was gone. The real problem appears when im trying to build any membrane structure along with my cg structure. In facts, Insane create my structure (membrane & protein) but, its wrong angle oriented.
So, i decide to use
- orient
Protein Alone
Protein + Membrane wrong oriented
Protein + Membrane oriented and explode
This is the command i use in insane=
python insane.py -salt 0.15 -x 10 -y 20 -z 10 -sol W:90 -sol WF:10 -l POPC:2 -l POPS:1 -f bac1_cg.gro -o bac1_mem.gro -d 10
Please Log in or Create an account to join the conversation.
Time to create page: 0.087 seconds