IsoStar 2.2.5

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Custom Plots

Although IsoStar contains data for many different functional groups, users may wish to generate their own scatterplots for contacts not currently included in the library. This may be done by performing a nonbonded search of the CSD with the program ConQuest and then converting the output to a scatterplot with the program IsoGen (see Tutorial 3 for more details). Scatterplots generated with IsoGen may then be placed in the IsoStar "Custom Plots" directory and hence made accessible to all users within an organisation.

This functionality is only available with an in-house installation of your own IsoStar server.

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