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IMPORTANT NOTE FOR UNREGISTERED USERS
by
tim
0
20070
12/30/13
09:42 AM
by
tim
READ BEFORE POSTING; updated March 2016
by
rmv
0
27770
05/28/12
05:54 PM
by
rmv
Sample scripts for basic tasks in CHARMM
(
1
2
3
4
all
)
by
lennart
33
89299
11/20/17
05:39 PM
by
rmv
Controling White Space
by
hlwood
3
11212
03/04/05
02:24 PM
by
hlwood
applying crystal symmetry
by
rmv
7
7240
12/02/19
04:45 PM
by
rmv
read-watbox.str
by
lennart
9
4209
03/21/19
09:39 AM
by
tyrion_jj
checking for water transits
by
rmv
4
1364
10/25/18
05:59 PM
by
rmv
self-diffusion-coeff.inp
(
1
2
all
)
by
lennart
15
24102
06/12/18
10:44 AM
by
lennart
rmsf calculation
by
abir
2
940
05/23/18
09:48 AM
by
abir
PDB with 2 segid WZ1 and WZ2 cannot read to create psf
by
Rohit
9
2487
11/24/17
01:58 AM
by
lennart
Charmm c40b1 g09 interface qm/mm script
by
jacquez88
3
1889
03/09/17
10:33 AM
by
jacquez88
implicit solvent for Acetonitrile
by
Hem@1
0
856
12/31/16
01:35 AM
by
Hem@1
Force field transformation from Gromacs to Charmm
by
Dawid
3
2132
12/30/16
01:27 PM
by
lennart
filling a box by placing molecules on a grid
by
rmv
9
10263
10/15/15
04:01 PM
by
fairoos
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