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ChemOffice.Com - CambridgeSoft

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Chapter 2: Registration System<br />

Overview<br />

Registration System is a powerful, web-based<br />

registration solution, part of the <strong>ChemOffice</strong><br />

Enterprise suite. The system includes a robust data<br />

model for pure compounds, batches, salt<br />

management, automatic duplicate checking, and<br />

unique ID assignments.<br />

As chemicals enter a laboratory, either via synthesis<br />

or procurement, they need to be characterized and<br />

tracked. Since chemical names are cumbersome,<br />

and one compound typically has many names, the<br />

name becomes a difficult identifier. The chemical<br />

structure, while more exact and recognizable,<br />

cannot be verbalized, and inclusion in written<br />

reports is difficult. The chemical registration<br />

number, by contrast, is a simple, compact, and<br />

unique way of identifying a chemical substance.<br />

Registration System<br />

Workflow<br />

The Registration System process begins by adding a<br />

compound to a temporary table space in the<br />

database. This is done using the "Add <strong>Com</strong>pound"<br />

button from the main menu. The user is taken to an<br />

"input" screen, and the ChemDraw plug-in starts<br />

on the client. The scientist should sketch the<br />

molecule and fill in all known information about<br />

that compound. If this is a new batch of an existing<br />

compound, click the "new batch" button and enter<br />

the existing compound's registry number. If this is<br />

a new compound, simply sketch the molecule in the<br />

box and complete the form.<br />

At some time, scheduled by a person designated as<br />

a scientific administrator, the compounds are<br />

formally "registered". Each compound or batch is<br />

checked against a list of existing entries for<br />

duplication. Duplicate checking is done using an<br />

advanced structure-matching algorithm, which<br />

checks the molecular drawing against the database.<br />

If no match is found, a new registry number is<br />

assigned. If a duplicate is found, the registrar is<br />

asked how to process the duplicate.<br />

Chemical Registry Number<br />

Assignment<br />

Registry numbers are drawn sequentially from a<br />

table. If a compound is ever removed from the<br />

database, its registry number will not be re-used.<br />

Starting Registration<br />

System<br />

When Registration System is opened, you must log<br />

in to start working.<br />

To open and log in to Registration System:<br />

1. Type http://hostname into your web<br />

browser.<br />

The main <strong>ChemOffice</strong> WebServer window<br />

appears.<br />

NOTE: Hostname is the name of the <strong>ChemOffice</strong><br />

WebServer machine. Contact your server administrator to<br />

obtain the correct hostname.<br />

2. Click Registration System.<br />

<strong>ChemOffice</strong> Enterprise Workgroup & Databases 2005 Registration System • 9<br />

Overview

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