{% extends "base.html" %} {% block content %} {% if nogo %}

Sorry, feature not enabled!

{% else %} {% if logedin %}
{% csrf_token %}
{% if single %}

Upload single molecule

Name and SMILES are required.
OpenMolDB automatically calculates properties from SMILES code.
{% csrf_token %}
{{form.smiles}}
{{form.name}}
{{form.altname}}
{{form.storage}}
{{form.storageid}}
{{form.platebarcode}}
{{form.samplebarcode}}
{{form.cas}}
{{form.supplier}}
{{form.supplierid}}
{{form.molclass}}
{{form.amount}}
{{form.unit}}
{{form.comment}}
{% endif %} {% if table %}

Upload csv table

OpenMolDB accepts comma seperated tables (.csv).
Tables should be saved in "Excel dialect" with comma as field delimiter and double quotes (") as text delimiter.
Recognized column names (Accepts UPPER and lower case):
name, SMILES, altname, storage, storageID, CAS, supplier, supplierID, amount, unit, comment, molclass, platebarcode, samplebarcode
Name and SMILES colums obligatory!
Properties calculated from SMILES (MW, LogP, HBA, HBD, TPSA, rot. bonds, complex., fsp3, PAINS, 2D mol file).
Recommended names for "molclass": chemical, hts, compound; for hts and compound PAINS can be calculated.
{% csrf_token %}
{{fileform.file}}
{% endif %} {% else %}

Please login to submit entries or upload tables.

Login
{% endif %} {% endif %} {% endblock %}