Register
Log In
CHARMM Development Project
Forums
CHARMM Interfaces
QM/MM Discussion and Questions
Search
Advanced Forum Search
Forums
Calendar
Active Threads
Page 1 of 29
1
2
3
…
28
29
Go to page...
Thread Title
Replies
Views
Last Post
IMPORTANT NOTE FOR UNREGISTERED USERS
by
tim
12/30/13
02:42 PM
tim
Replies: 0
Views: 31,421
0
31,421
12/30/13
02:42 PM
by
tim
READ BEFORE POSTING (please)
by
rmv
05/28/12
09:54 PM
rmv
Replies: 0
Views: 38,897
0
38,897
05/28/12
09:54 PM
by
rmv
QChem input file generated by CHARMM in QM/MM
by
Alpha
01/13/22
05:22 PM
Alpha
Replies: 2
Views: 571
2
571
01/13/22
05:22 PM
by
Alpha
Adding more than 1 link atom in QM/MM
by
Alpha
01/12/22
07:23 AM
Alpha
Replies: 0
Views: 257
0
257
01/12/22
07:23 AM
by
Alpha
QMMM with the CHARMM-TURBOMOLE interface
by
sreeganb
12/15/21
07:14 PM
sreeganb
Replies: 0
Views: 266
0
266
12/15/21
07:14 PM
by
sreeganb
Hydrogens Came off & Sugar Ring Twisted during Minimization
by
HBfrindle
06/08/21
08:38 PM
HBfrindle
Replies: 0
Views: 767
0
767
06/08/21
08:38 PM
by
HBfrindle
QCHEM and umbrella sampling
by
bnumn
04/26/21
01:16 PM
Jinfeng
Replies: 1
Views: 609
1
609
04/26/21
01:16 PM
by
Jinfeng
CHARMM constrained QM/MM dynamics crashes
by
sreeganb
03/25/21
06:44 AM
sreeganb
Replies: 2
Views: 833
2
833
03/25/21
06:44 AM
by
sreeganb
Segmentation fault - invalid memory reference in QMMM minimi
by
vht
01/25/21
06:11 AM
vht
Replies: 1
Views: 890
1
890
01/25/21
06:11 AM
by
vht
Reaction dynamcs with umbrella sampling
by
ErandiUSJP
01/15/21
04:46 AM
ErandiUSJP
Replies: 0
Views: 408
0
408
01/15/21
04:46 AM
by
ErandiUSJP
SCCDFTB not converged in qm/mm minimization step
by
vht
08/12/20
08:59 AM
Corey Taylor
Replies: 4
Views: 1,719
4
1,719
08/12/20
08:59 AM
by
Corey Taylor
ENDselection terminator missing
by
vht
08/05/20
03:21 PM
rmv
Replies: 1
Views: 731
1
731
08/05/20
03:21 PM
by
rmv
Moderated by:
BRBrooks
,
lennart
,
rmv
Page 1 of 29
1
2
3
…
28
29
Go to page...
Category Display Options
Show From Previous
1 Day
2 Days
1 Week
2 Weeks
3 Weeks
1 Month
3 Months
6 Months
1 Year
All Threads
Sort by
Last Post Time
Created Time
Thread Title
Replies
Starter
Views
Ascending
Descending
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
RSS: CHARMM forums: QM/MM discussions and questions
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~deb10u1
Page Time:
0.008s
Queries:
11 (0.004s)
Memory:
0.7592 MB (Peak: 0.8683 MB)
Data Comp:
Off
Server Time:
2022-08-13 09:58:16 UTC
Valid HTML 5
and
Valid CSS