İptal Edildi

ChemDraw tool modification in VB6

Nature Publishing Group (NPG), the scientific publishing arm of Macmillan Publishers Ltd., is interested in automating processes within ChemDraw, a chemical structure drawing program. NPG currently uses ChemDraw for collecting chemical structures from authors, collating those materials and creating exports of individual compounds for use in production systems as well as information delivery to external databases. The current process is manual; NPG would like an automated solution.

An initial round of development work by the makers of ChemDraw has already been completed and produced a tool that nearly, but not completely, addresses NPG's needs. Some modifications still need to be made that I will attempt to describe below.

The VB code itself is short and the actual modifications I trust are not very difficult. I don't expect the project to take more than a day's effort.


1. A master .cdx (ChemDraw) file is provided by NPG containing a set of ChemDraw structures each grouped with a text box containing the compound number, and either the systematic name, the IUPAC name (chemical names) or both.

2. The tool seperates the components.

3. The tool then takes the newly created .cdx files associated with the individual structures and creates .cml, .gif and .mol files for each structure (the tool just leverages these standard ChemDraw outputs).

4. It then processes the text associated with each structure and converts it to a spread sheet for cross-referencing the structures with the naming information in a tab-delimited file format.


1. A master .cdx file as well as an initial tab-delimited file is provided by NPG. The .cdx file contains the structure drawing and the compound number only. The tab-delimited file contains the compound number and chemical names.

2. The tool seperates the components of the .cdx file (doesnt look for chemical name anymore just compound number)

3. (this is the same) The tool then takes the newly created .cdx files associated with the individual structures and creates .cml, .gif and .mol files for each

structure (the tool just leverages these standard ChemDraw outputs).

[login to view URL] the comound numbers in both the master .cdx and tab-delimited file as an index, the tool creates a new spread sheet matching the correct .mol file output names with the correct chemical names.

The tool requires ChemDraw 9 Ultra in order to run. It is much prefered if the contractor supplies his/her own copy.

Source code and further details of the tool available upon bid & request.

Beceriler: Visual Basic

Daha fazlasını gör: source code chemdraw, vb6 mol file, ultra scientific, round name, production tool, just publishing, in vb6.0, group publishing, file expect, expect file, associated materials, and in vb6, chemdraw source code, modification vb6, chemical drawing, box master, vb short work, ultra, tool, systematic, structures, structure drawing, some modification, run sheet, production drawing

İşveren Hakkında:
( 0 değerlendirme ) New York, United States

Proje NO: #55305

Bu iş için 3 freelancer ortalamada $137 teklif veriyor


we can do it.

in %bids___i_period_sub_35% gün içinde150%project_currencyDetails_sign_sub_37% %project_currencyDetails_code_sub_38%
(1 Yorum)

I can do this project for you. My expertise covers development, debugging, re-engineering, maintenance and support. I can re-enginneer and debug the existing module to fit in your requirements with a neat and clean app Daha Fazla

1 gün içinde %bids___i_sum_sub_32%%project_currencyDetails_sign_sub_33% USD
(1 Yorum)

hi, we have a good team of VB and VB.NET developers with experience in ERP, Hotel Management and Inventory Management Softwares. Pls contact with your yahoo id so we can get this started...best regards..manish

in %bids___i_period_sub_35% gün içinde160%project_currencyDetails_sign_sub_37% %project_currencyDetails_code_sub_38%
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