1 {% extends "base.html" %}
3 {% load i18n lazysignup_tags %}
6 <ul class="list-group">
8 <li class="list-group-item new-task-item task-item">
10 <div class="col-xs-3 form-group">
11 <form action="/refresh_done1/{{task.id}}/" method="post">
13 <input type="submit" class="btn" value="Refresh" name="refreshbtn">
17 <div class="col-xs-10 form-group">
18 <h5 style="text-align:right;float:right;">
19 {% if not task.done %}
20 {% if task.running > 0 %}
21 {% if task.running == 100 %}
27 waiting in the queue to start
35 <h3> All parameters for task <b>{{ task.name }}</b></h3>
36 Created {{ task.created_date }}
37 <ul class="list-group">
39 <li class="list-group-item task-item">
40 <div class="col-xs-10"> done ?</div>
41 <div class="col-xs-10">
43 <span class="fa fa-check-square-o"></span>
45 {% if task.running > 0 %}
46 <span class="fa fa-spinner
50 <span class="fa fa-square-o"></span>
56 <li class="list-group-item task-item">
57 <div class="col-xs-10"> type </div>
58 <div class="col-xs-10">{{ task.type }}</div>
61 <li class="list-group-item task-item">
62 <div class="col-xs-10"> force field </div>
63 <div class="col-xs-10">{{ task.unres_ff }}</div>
66 <li class="list-group-item task-item">
67 <div class="col-xs-10"> sequence </div>
68 <div class="col-xs-10">{{ task.md_seq}}</div>
71 <li class="list-group-item task-item">
72 <div class="col-xs-10"> SSBOND </div>
73 <div class="col-xs-10">{{ task.ssbond}}</div>
77 {% if task.type == "min" %}
80 <li class="list-group-item task-item">
81 <div class="col-xs-10"> algorithm</div>
82 <div class="col-xs-10">{{ task.min_choice }}</div>
84 <li class="list-group-item task-item">
85 <div class="col-xs-10"> overlap</div>
86 <div class="col-xs-10">{{ task.min_overlap }}</div>
88 <li class="list-group-item task-item">
89 <div class="col-xs-10"> searchsc</div>
90 <div class="col-xs-10">{{ task.min_searchsc }}</div>
92 <li class="list-group-item task-item">
93 <div class="col-xs-10"> maxmin</div>
94 <div class="col-xs-10">{{ task.min_maxmin }}</div>
96 <li class="list-group-item task-item">
97 <div class="col-xs-10"> maxfun</div>
98 <div class="col-xs-10">{{ task.min_maxfun }}</div>
100 <li class="list-group-item task-item">
101 <div class="col-xs-10"> pdbout</div>
102 <div class="col-xs-10">{{ task.min_pdbout }}</div>
104 <li class="list-group-item task-item">
105 <div class="col-xs-10"> input pdb </div>
106 <div class="col-xs-10">{{ task.myfile1 }}</div>
108 <li class="list-group-item task-item">
109 <div class="col-xs-10"> unres_pdb</div>
110 <div class="col-xs-10">{{ task.min_unres_pdb }}</div>
114 {% if task.type == "md" %}
115 <li class="list-group-item task-item">
116 <div class="col-xs-10"> starting </div>
117 <div class="col-xs-10">{{ task.md_start}}</div>
120 <li class="list-group-item task-item">
121 <div class="col-xs-10"> input pdb </div>
122 <div class="col-xs-10">{{ task.myfile1 }}</div>
124 <li class="list-group-item task-item">
125 <div class="col-xs-10"> seed </div>
126 <div class="col-xs-10">{{ task.md_seed}}</div>
128 <li class="list-group-item task-item">
129 <div class="col-xs-10"> pdbref </div>
130 <div class="col-xs-10">{{ task.md_pdbref}}</div>
132 <li class="list-group-item task-item">
133 <div class="col-xs-10"> respa </div>
134 <div class="col-xs-10">{{ task.md_respa}}</div>
136 <li class="list-group-item task-item">
137 <div class="col-xs-10"> temperature </div>
138 <div class="col-xs-10">{{ task.md_temp}}</div>
140 <li class="list-group-item task-item">
141 <div class="col-xs-10"> nstep </div>
142 <div class="col-xs-10">{{ task.md_nstep}}</div>
144 <li class="list-group-item task-item">
145 <div class="col-xs-10"> ntwe </div>
146 <div class="col-xs-10">{{ task.md_ntwe}}</div>
148 <li class="list-group-item task-item">
149 <div class="col-xs-10"> ntwx </div>
150 <div class="col-xs-10">{{ task.md_ntwx}}</div>
152 <li class="list-group-item task-item">
153 <div class="col-xs-10"> dt </div>
154 <div class="col-xs-10">{{ task.md_dt}}</div>
156 <li class="list-group-item task-item">
157 <div class="col-xs-10"> thermostat </div>
158 <div class="col-xs-10">{{ task.md_lang}}</div>
161 {% if task.md_lang == "berendsen" %}
163 <li class="list-group-item task-item">
164 <div class="col-xs-10"> tau </div>
165 <div class="col-xs-10">{{ task.md_tau}}</div>
170 <li class="list-group-item task-item">
171 <div class="col-xs-10"> scal_fric </div>
172 <div class="col-xs-10">{{ task.md_scal_fric}}</div>
177 <li class="list-group-item task-item">
178 <div class="col-xs-10"> mdpdb </div>
179 <div class="col-xs-10">{{ task.md_mdpdb}}</div>
183 {% if task.type == "remd" %}
185 <li class="list-group-item task-item">
186 <div class="col-xs-10"> nrep </div>
187 <div class="col-xs-10">{{ task.remd_nrep}}</div>
189 <li class="list-group-item task-item">
190 <div class="col-xs-10"> starting </div>
191 <div class="col-xs-10">{{ task.md_start}}</div>
194 <li class="list-group-item task-item">
195 <div class="col-xs-10"> input pdb </div>
196 <div class="col-xs-10">{{ task.myfile1 }}</div>
198 <li class="list-group-item task-item">
199 <div class="col-xs-10"> seed </div>
200 <div class="col-xs-10">{{ task.md_seed}}</div>
202 <li class="list-group-item task-item">
203 <div class="col-xs-10"> pdbref </div>
204 <div class="col-xs-10">{{ task.md_pdbref}}</div>
206 <li class="list-group-item task-item">
207 <div class="col-xs-10"> respa </div>
208 <div class="col-xs-10">{{ task.md_respa}}</div>
210 <li class="list-group-item task-item">
211 <div class="col-xs-10"> nstep </div>
212 <div class="col-xs-10">{{ task.md_nstep}}</div>
214 <li class="list-group-item task-item">
215 <div class="col-xs-10"> ntwe </div>
216 <div class="col-xs-10">{{ task.md_ntwe}}</div>
218 <li class="list-group-item task-item">
219 <div class="col-xs-10"> nstex </div>
220 <div class="col-xs-10">{{ task.remd_nstex}}</div>
222 <li class="list-group-item task-item">
223 <div class="col-xs-10"> ntwx </div>
224 <div class="col-xs-10">{{ task.md_ntwx}}</div>
226 <li class="list-group-item task-item">
227 <div class="col-xs-10"> dt </div>
228 <div class="col-xs-10">{{ task.md_dt}}</div>
230 <li class="list-group-item task-item">
231 <div class="col-xs-10"> thermostat </div>
232 <div class="col-xs-10">{{ task.md_lang}}</div>
235 {% if task.md_lang == "berendsen" %}
237 <li class="list-group-item task-item">
238 <div class="col-xs-10"> tau </div>
239 <div class="col-xs-10">{{ task.md_tau}}</div>
244 <li class="list-group-item task-item">
245 <div class="col-xs-10"> scal_fric </div>
246 <div class="col-xs-10">{{ task.md_scal_fric}}</div>
251 <li class="list-group-item task-item">
252 <div class="col-xs-10"> temperatures </div>
253 <div class="col-xs-10">{{ task.remd_multi_t}}</div>
255 <li class="list-group-item task-item">
256 <div class="col-xs-10"> multiplex </div>
257 <div class="col-xs-10">{{ task.remd_multi_m}}</div>
259 <li class="list-group-item task-item">
260 <div class="col-xs-10"> temperature for clustering</div>
261 <div class="col-xs-10">{{ task.remd_cluter_temp}}</div>
267 <li class="list-group-item task-item">
268 <div class="col-xs-10"> Box X Y Z</div>
269 <div class="col-xs-3">{{ task.boxx}}</div>
270 <div class="col-xs-3">{{ task.boxy}}</div>
271 <div class="col-xs-3">{{ task.boxz}}</div>
277 <li class="list-group-item task-item">
278 <div class="col-xs-10"> Directory </div>
279 <div class="col-xs-10">
280 <a href="/myfiles/list/{{task.jobdirname}}/">
281 {{ task.jobdirname }}
289 {% if task.type == "min" %}
291 <li class="list-group-item task-item">
292 <div class="col-xs-10"> Etot </div>
293 <div class="col-xs-10">{{ task.etot }}</div>
296 <li class="list-group-item task-item">
297 <div class="col-xs-10"> UNRES model </div>
298 <div class="col-xs-10">
300 href="/myfiles/download-file/{{task.jobdirname}}/unres.pse">
302 src="/myfiles/download-file/{{task.jobdirname}}/unres.png"
303 width="500"></a> </div>
307 <li class="list-group-item task-item">
308 <div class="col-xs-10"> Structure overlap </div>
309 <div class="col-xs-10"> <img
310 src="/myfiles/download-file/{{task.jobdirname}}/unres_overlap.png"
317 <li class="list-group-item task-item">
318 <div class="col-xs-10"> Results </div>
319 <div class="col-xs-10">{{ task.results_text|linebreaks }}</div>
322 {% if task.type == "md" %}
324 <li class="list-group-item task-item">
325 <div class="col-xs-10"> Temperature histogram </div>
326 <div class="col-xs-10"> <img
327 src="/myfiles/download-file/{{task.jobdirname}}/temp_hist.png"
331 <li class="list-group-item task-item">
332 <div class="col-xs-10"> Potential energy </div>
333 <div class="col-xs-10"> <img
334 src="/myfiles/download-file/{{task.jobdirname}}/md_ene.png"
338 <li class="list-group-item task-item">
339 <div class="col-xs-10"> Movie </div>
340 <div class="col-xs-10">
342 <video width="500" height="400" preload controls>
344 src="/myfiles/download-file/{{task.jobdirname}}/md.ogv"
345 type="video/ogg; codecs=theora"> </source>
351 <li class="list-group-item task-item">
352 <div class="col-xs-10"> Radius of gyration based
353 on C<sup>α</sup> coordinates </div>
354 <div class="col-xs-10"> <img
355 src="/myfiles/download-file/{{task.jobdirname}}/md_gyr.png"
361 {% if task.md_pdbref %}
362 <li class="list-group-item task-item">
363 <div class="col-xs-10"> RMSD </div>
364 <div class="col-xs-10"> <img
365 src="/myfiles/download-file/{{task.jobdirname}}/md_rms.png"
369 <li class="list-group-item task-item">
370 <div class="col-xs-10"> fraction of native
371 side-chain concacts </div>
372 <div class="col-xs-10"> <img
373 src="/myfiles/download-file/{{task.jobdirname}}/md_fracn.png"
379 {% if task.md_start == "pdbstart" %}
380 <li class="list-group-item task-item">
381 <div class="col-xs-10"> fluctuations </div>
382 <div class="col-xs-10"> <img
383 src="/myfiles/download-file/{{task.jobdirname}}/fluct_plot.png"
387 <li class="list-group-item task-item">
388 <div class="col-xs-10"> fluctuations putty on
389 starting structure</div>
390 <div class="col-xs-10">
392 href="/myfiles/download-file/{{task.jobdirname}}/fluct.pse">
394 src="/myfiles/download-file/{{task.jobdirname}}/fluct.png"
395 width="500"></a> </div>
404 {% if task.type == "remd" %}
406 <li class="list-group-item task-item">
407 <div class="col-xs-10"> Energy histogram </div>
408 <div class="col-xs-10"> <img
409 src="/myfiles/download-file/{{task.jobdirname}}/remd_ene_hist.png"
413 <li class="list-group-item task-item">
414 <div class="col-xs-10"> Energy vs. temperature </div>
415 <div class="col-xs-10"> <img
416 src="/myfiles/download-file/{{task.jobdirname}}/remd_Tene.png"
420 <li class="list-group-item task-item">
421 <div class="col-xs-10"> Cv vs. temperature </div>
422 <div class="col-xs-10"> <img
423 src="/myfiles/download-file/{{task.jobdirname}}/remd_cv.png"
427 {% if task.md_pdbref %}
429 <li class="list-group-item task-item">
430 <div class="col-xs-10"> Average RMSD vs. temperature </div>
431 <div class="col-xs-10"> <img
432 src="/myfiles/download-file/{{task.jobdirname}}/remd_rmsd.png"
436 <li class="list-group-item task-item">
437 <div class="col-xs-10"> potential energy vs. RMSD</div>
438 <div class="col-xs-10"> <img
439 src="/myfiles/download-file/{{task.jobdirname}}/remd_ene_rms.png"
443 <li class="list-group-item task-item">
444 <div class="col-xs-10"> RMSD vs. step*replica
445 colored by bath temperature</div>
446 <div class="col-xs-10"> <img
447 src="/myfiles/download-file/{{task.jobdirname}}/remd_step_rms.png"
454 <li class="list-group-item task-item">
455 <div class="col-xs-10"> exchanges (walk in T) </div>
456 <div class="col-xs-10"> <img
457 src="/myfiles/download-file/{{task.jobdirname}}/remd_ex.png"
461 <li class="list-group-item task-item">
462 <div class="col-xs-10"> model1 after conversion
464 {{ task.remd_model1|linebreaks }}
466 <div class="col-xs-10">
468 href="/myfiles/download-file/{{task.jobdirname}}/MODEL1.pdb">
470 src="/myfiles/download-file/{{task.jobdirname}}/model1.png" width="500">
473 <li class="list-group-item task-item">
474 <div class="col-xs-10"> model2 after conversion
476 {{ task.remd_model2|linebreaks }}
478 <div class="col-xs-10">
480 href="/myfiles/download-file/{{task.jobdirname}}/MODEL2.pdb">
482 src="/myfiles/download-file/{{task.jobdirname}}/model2.png" width="500">
485 <li class="list-group-item task-item">
486 <div class="col-xs-10"> model3 after conversion
488 {{ task.remd_model3|linebreaks }}
490 <div class="col-xs-10">
492 href="/myfiles/download-file/{{task.jobdirname}}/MODEL3.pdb">
494 src="/myfiles/download-file/{{task.jobdirname}}/model3.png" width="500">
497 <li class="list-group-item task-item">
498 <div class="col-xs-10"> model4 after conversion
500 {{ task.remd_model4|linebreaks }}
502 <div class="col-xs-10">
504 href="/myfiles/download-file/{{task.jobdirname}}/MODEL4.pdb">
506 src="/myfiles/download-file/{{task.jobdirname}}/model4.png" width="500">
509 <li class="list-group-item task-item">
510 <div class="col-xs-10"> model5 after conversion
512 {{ task.remd_model5|linebreaks }}
514 <div class="col-xs-10">
516 href="/myfiles/download-file/{{task.jobdirname}}/MODEL5.pdb">
518 src="/myfiles/download-file/{{task.jobdirname}}/model5.png" width="500">