Register
Log In
CHARMM Development Project
Forums
CHARMM Interfaces
CHARMMing
Keeping protein rigid during minimization
Search
Advanced Forum Search
Forums
Calendar
Active Threads
Previous Thread
Next Thread
Print Thread
Keeping protein rigid during minimization
#
36015
11/10/16
09:39 AM
Joined:
Aug 2016
Posts: 2
Poland
KKuder
OP
Forum Member
OP
KKuder
Forum Member
Joined:
Aug 2016
Posts: 2
Poland
How can I keep the protein rigid or at least put a hefty restraint on the protein atoms using CHARMMING? I just need to minimize ligand itself from the protein-ligand complex
Thx for answering
Copy Link to Clipboard
Moderated by
hlwood
,
lennart
,
rmv
Hop To
User Discussion & Questions ------
Setup, I/O, and Basic questions
Energy terms, Constraints, Rest...
Parameter Set Discussion
Molecular Dynamics
Minimization, Normal modes, Mon...
Installation and Testing
Performance and Benchmarking
Other User Discussion and Questions
General Chemistry Discussions
CHARMM Interfaces ------
QM/MM Discussion and Questions
CHARMMing
CHARMM-GUI
MMTSB
Accelrys
CHARMM Community ------
Script Archive
Bug Reports & Fixes
Meetings & Events
Position Openings
CHARMM Course
Suggestions and Requests
Forum News and Announcements
Print Thread
Switch to Threaded Mode
Show Likes
Link Copied to Clipboard
View Profile
Private Message
Follow User
Forum Posts
Like Summary
Default Style
UBBT77
UBBT77
UBBT77 - Dark
UBBT77 - Dark
ubbthreads-dark
ubbthreads stock
Forum Rules
·
Mark All Read
Privacy policy
HHS Responsible Disclosure Program
Site Tech Support
·
Forum Help
·
CHARMM Development Project
Powered by UBB.threads™ PHP Forum Software 7.7.5
(Release build 20201027)
Responsive Width:
PHP:
7.3.31-1~deb10u3
Page Time:
0.007s
Queries:
15 (0.005s)
Memory:
0.7220 MB (Peak: 0.7567 MB)
Data Comp:
Off
Server Time:
2023-06-09 12:00:24 UTC
Valid HTML 5
and
Valid CSS