X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=django_simple%2Ftodo%2Ftemplates%2Fdetails.html;h=bf3cc549e9454e55512e1c7812f372f078004fc8;hb=a59ed9fccce9251f366fdddc844f48910d808d2f;hp=550d346f620552b70c201c10d86e2655547aa84b;hpb=591ac48194b207c02ffd7cda59c1c9709a114498;p=django_unres.git
diff --git a/django_simple/todo/templates/details.html b/django_simple/todo/templates/details.html
index 550d346..bf3cc54 100644
--- a/django_simple/todo/templates/details.html
+++ b/django_simple/todo/templates/details.html
@@ -20,6 +20,11 @@ Created {{ task.created_date }}
type
{{ task.type }}
+
+
+ force field
+ {{ task.unres_ff }}
+
sequence
@@ -115,14 +120,23 @@ Created {{ task.created_date }}
thermostat
{{ task.md_lang}}
+
+ {% if task.md_lang == "berendsen" %}
+
tau
{{ task.md_tau}}
+
+ {% else %}
+
scal_fric
{{ task.md_scal_fric}}
-
+
+
+ {% endif %}
+
mdpdb
{{ task.md_mdpdb}}
@@ -161,10 +175,18 @@ Created {{ task.created_date }}
{{ task.md_nstep}}
+ ntwe
+ {{ task.md_ntwe}}
+
+
nstex
{{ task.remd_nstex}}
+ ntwx
+ {{ task.md_ntwx}}
+
+
dt
{{ task.md_dt}}
@@ -172,14 +194,23 @@ Created {{ task.created_date }}
thermostat
{{ task.md_lang}}
+
+ {% if task.md_lang == "berendsen" %}
+
tau
{{ task.md_tau}}
+
+ {% else %}
+
scal_fric
{{ task.md_scal_fric}}
-
+
+
+ {% endif %}
+
temperatures
{{ task.remd_multi_t}}
@@ -188,6 +219,11 @@ Created {{ task.created_date }}
multiplex
{{ task.remd_multi_m}}
+
+ temperature for clustering
+ {{ task.remd_cluter_temp}}
+
+
{% endif %}
@@ -266,6 +302,15 @@ Created {{ task.created_date }}
+
+
+ Radius of gyration based
+ on Cα coordinates
+
+
+
{% if task.md_pdbref %}
@@ -275,8 +320,40 @@ Created {{ task.created_date }}
src="/myfiles/download-file/{{task.jobdirname}}/md_rms.png"
width="500">
+
+
+ fraction of native
+ side-chain concacts
+
+
{% endif %}
+
+ {% if task.md_start == "pdbstart" %}
+
+ fluctuations
+
+
+
+
+ fluctuations putty on
+ starting structure
+
+
+
+ {% endif %}
+
+
+
{% endif %}
{% if task.type == "remd" %}
@@ -318,6 +395,14 @@ Created {{ task.created_date }}
width="500">
+
+ RMSD vs. step*replica
+ colored by bath temperature
+
+
+
{% endif %}
@@ -330,7 +415,9 @@ Created {{ task.created_date }}
model1 after conversion
- to allatom with PULCHRA and SCWRL
+ to allatom
+ {{ task.remd_model1|linebreaks }}
+