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rmcgibbo
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openmm-webbuilder
JS/HTML5 webapp for setting up custom GPU-accelerated OpenMM molecular dynamics simulations.
http://builder.openmm.org
GNU General Public License v3.0
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Corrects a typo in implicitSolvent keyword
#30
avirshup
closed
7 years ago
1
Save script directly from client
#29
peastman
closed
7 years ago
0
Support AMBER rst files, grey out water model with prmtop
#28
rmcgibbo
opened
9 years ago
0
Add .travis.yml for heroku deploy
#27
rmcgibbo
closed
9 years ago
0
BLD: Auto-deploy to Heroku
#26
rmcgibbo
closed
9 years ago
0
Update views.js
#25
rmcgibbo
closed
9 years ago
1
Fix typo 'implicitSovlent' in views.js/155-156
#24
sudipto-mukherjee
closed
9 years ago
3
Specify simulation time as alternative to number of steps
#23
mpharrigan
opened
10 years ago
1
thermostat dropdown only shows None
#22
rmcgibbo
opened
10 years ago
1
Specifying water model for AMBER input files?
#21
frabjous5
opened
10 years ago
1
Add calls to modeler.addExtraParticles when using TIP4P-Ew or TIP5P
#20
rmcgibbo
opened
10 years ago
0
More reporter options
#19
rmcgibbo
closed
10 years ago
2
Change separator to `\t` instead of `, ` in StateDataReporter
#18
rmcgibbo
closed
10 years ago
1
Add CPU platform and new reporter options
#17
rmcgibbo
closed
10 years ago
0
Add CPU platform.
#16
rmcgibbo
closed
10 years ago
0
Add PDB reporter in addition to the DCD reporter option
#15
gkiss
opened
10 years ago
6
Script "system" parameter unassigned for amber and gromacs inputs
#14
sryckbos
closed
11 years ago
2
Live visualization through Script Builder
#13
frabjous5
opened
11 years ago
1
Gromacs input option?
#12
sryckbos
closed
11 years ago
2
Add SWM4-NDP water model (OpenMM 5.2)
#11
rmcgibbo
opened
11 years ago
2
don't use import *
#10
rmcgibbo
closed
11 years ago
0
visibility mechanism don't allow the visibility of an attribute in one model to depend upon the selection in another
#9
rmcgibbo
closed
10 years ago
0
Grey out MonteCarloBarostat with implicit solvent
#8
rmcgibbo
closed
11 years ago
1
Download PDB?
#7
kyleabeauchamp
opened
11 years ago
4
Logging analytics on the "save script" button.
#6
rmcgibbo
closed
11 years ago
1
"Run Script" Button
#5
rmcgibbo
opened
11 years ago
1
AMOEBA support
#4
rmcgibbo
opened
11 years ago
0
stuff
#3
rmcgibbo
closed
11 years ago
0
websocket
#2
rmcgibbo
closed
11 years ago
0
Pop-up help box oes not automatically disappear
#1
proteneer
closed
11 years ago
1