X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=django_simple%2Ftodo%2Ftemplates%2Fdetails.html;h=5ca318794e35180cf4ef58b451f0bb0e6f088317;hb=1b9e4cd5192fafe2213b582fadd19556fb2ecf3a;hp=bf3b46b0208a0281a2325ca9c325ed4a433ea751;hpb=93605db97d405db5c7572338a4e5ab11fe4e402b;p=django_unres.git diff --git a/django_simple/todo/templates/details.html b/django_simple/todo/templates/details.html index bf3b46b..5ca3187 100644 --- a/django_simple/todo/templates/details.html +++ b/django_simple/todo/templates/details.html @@ -1,5 +1,6 @@ {% extends "base.html" %} +{% load index %} {% load i18n lazysignup_tags %} {% block content %} @@ -8,14 +9,14 @@
  • -
    +
    {% csrf_token %}
    -
    +
    {% if not task.done %} {% if task.running > 0 %} @@ -39,15 +40,30 @@ Created {{ task.created_date }}
    • -
      done ?
      -
      +
      done ?
      +
      {% if task.done %} + {% if task.type == "md" or task.type == "remd" or task.type == "dock" %} +
      + {% csrf_token %} + + +
      + {% endif %} {% else %} {% if task.running > 0 %} {{ task.running }}% + {% if task.running == 100 %} + postprocessing + {% endif %} {% else %} {% endif %} @@ -55,30 +71,43 @@ Created {{ task.created_date }}
      • - +
      Expand input parameters + style="background-color:#d3d3d3;cursor: pointer;">Show input parameters +

      Results

    • -
      Directory
      -
      +
      Directory
      +
      {{ task.jobdirname }} + {% if task.done %} +   + + Download as zip + {% endif %}
      • @@ -309,57 +410,77 @@ Created {{ task.created_date }} {% if task.type == "min" %}
    • -
      Etot
      -
      {{ task.etot }}
      +
      Etot
      +
      {{ task.etot }}
      • - + +
    • +
      UNRES model NGL viewer
      +
      +
      +
      • + +
    • +
      Structure overlap NGL viewer
      +
      +
      +
      • +
    • +
      + + +
      +
      • {% endif %}
    • -
      Results
      -
      {{ task.results_text|linebreaks }}
      +
      Results
      +
      {{ task.results_text|linebreaks }}
      • {% if task.type == "md" %}
    • -
      Temperature histogram
      -
      Temperature histogram
      +
    • -
      Potential energy
      -
      Potential energy
      +
    • -
      Movie
      -
      +
      Movie
      +
      -
      • + +{% if task.md_mdpdb %} +
    • +
      Trajectory NGL viewer
      +
      +
      +
      • +
    • +
      +1 frame +
      +
      + + +
      +
      • + +{% endif %}
    • -
      Radius of gyration based +
      Radius of gyration based on Cα coordinates
      -
      • @@ -380,16 +520,16 @@ Created {{ task.created_date }} {% if task.md_pdbref %}
    • -
      RMSD
      -
      Cα RMSD
      +
    • -
      fraction of native +
      fraction of native side-chain concacts
      -
      • @@ -398,22 +538,31 @@ Created {{ task.created_date }} {% if task.md_start == "pdbstart" %}
    • -
      fluctuations
      -
      fluctuations
      +
      • - + +
    • +
      fluctuations putty on + starting structure NGL viewer
      +
      +
      +
      • + {% endif %} @@ -421,25 +570,25 @@ Created {{ task.created_date }} {% endif %} - {% if task.type == "remd" %} + {% if task.type == "remd" or task.type == "dock" %}
    • -
      Energy histogram
      -
      Energy histogram
      +
    • -
      Energy vs. temperature
      -
      Energy vs. temperature
      +
    • -
      Cv vs. temperature
      -
      Cv vs. temperature
      +
      • @@ -447,23 +596,24 @@ Created {{ task.created_date }} {% if task.md_pdbref %}
    • -
      Average RMSD vs. temperature
      -
      Average Cα RMSD vs. temperature
      +
    • -
      potential energy vs. RMSD
      -
      potential energy vs. + Cα RMSD
      +
    • -
      RMSD vs. step*replica +
      Cα RMSD vs. step*replica colored by bath temperature
      -
      • @@ -472,74 +622,98 @@ Created {{ task.created_date }} {% endif %}
    • -
      exchanges (walk in T)
      -
      exchanges (walk in T)
      +
      • - -
    • -
      model1 after conversion - to allatom - {{ task.remd_model1|linebreaks }} -
      -
      - - -
      -
      • -
    • -
      model2 after conversion - to allatom - {{ task.remd_model2|linebreaks }} -
      -
      - - -
      -
      • -
    • -
      model3 after conversion - to allatom - {{ task.remd_model3|linebreaks }} -
      -
      - - -
      -
      • + + {% if task.saxs_data != "" %}
    • -
      model4 after conversion - to allatom - {{ task.remd_model4|linebreaks }} -
      -
      - - -
      +
      P(r) of input SAXS data and + calculated for 5 models and the input pdb
      +
      • + {% endif %} + +
    • +
      + +
      +
      + select model +
      +
      + +
      +
      • + + {% for iii in range %} + + {% with istr=forloop.counter|stringformat:"s" %} + {% with MODELi="MODEL"|add:istr|add:".pdb" %} + {% with viewporti="viewport_M"|add:istr %} + {% with toggleRefi="toggleRefM"|add:istr %} + {% with toggleSidechainsi="toggleSidechainsM"|add:istr %} + +
    • -
      model5 after conversion - to allatom - {{ task.remd_model5|linebreaks }} +
      model {{ iii }} + {% if not task.damino %} + after conversion to allatom + {% endif %} + {{ remd_models|index:iii|linebreaks }} + NGL viewer
      +
      -
      - - -
      • +
    • +
      + {% if task.md_pdbref %} + + {% endif %} + + Download +
      +
      • + + {% if task.use_nmr %} +
    • +
      + +
      +
      + select model +
      +
      + +
      +
      • +
    • +
      + + {% with temper=task.remd_cluter_temp|add:"0" %} + NMR contacts of best NMR fitted family representative model + (clustered in {{temper}}K). Model number {{iii}}: +
      +
      • + {% endwith %} + {% endif %} + +
      + {% endwith %} + {% endwith %} + {% endwith %} + {% endwith %} + {% endwith %} + {% endfor %} - {% endif %} {% endif %} @@ -547,17 +721,449 @@ Created {{ task.created_date }}
    + - - + +{% if task.type == "remd" or task.type == "dock" %} + +{% endif %} + +{% if not task.done %} + +{% endif %} + +{% if task.type == "min" %} + +{% endif %} + +{% if task.type == "md" and task.md_start == "pdbstart" %} + +{% endif %} + +{% if task.type == "md" and task.md_mdpdb %} + +{% endif %} + + {% endblock %}