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aocr-2.0 Utility Guide

5. How to proceed with the examples

5.4. Synthesis of lactone

Set the Computation Tool in the following way, where no indication means to leave the field empty or the box unchecked:

1. Computation

MAIN: start

LIST OF RULES: Refer to the beginnig of this chapter.

START COMPOUNDS: lc2.grf (in the directory docs/examples/lactone below the installation base aocr-2.0)

SEARCHED COMPOUNDS: lc1.grf (in the directory docs/examples/lactone below the installation base)

TWO STEPS IN ONE: checked

GENERATION LEVELS: 1-2

RULE APPLICATION BOUND: 4

DISTINCT: checked

DERIVATION: (for example) lc1.drv (in the directory docs/examples/lactone below the installation base)

The program should have found a synthesis!

2. Computation

(faster by restricting the domain):

MAIN: start

LIST OF RULES: Refer to the beginnig of this chapter.

START COMPOUNDS: lc2.grf (in the directory docs/examples/lactone below the installation base)

SEARCHED COMPOUNDS: lct1.grf (in the directory docs/examples/lactone below the installation base)

TWO STEPS IN ONE: checked

GENERATION LEVELS: 1-2

RULE APPLICATION BOUND: 4

DOMAIN: 0,1,7,8,10,12,18,24-25

DERIVATION: (for example) lc2.drv (in the directory docs/examples/lactone below the installation base)

The program should have found a synthesis! Another solution can be found by running:

3. Computation

MAIN: continue

GENERATION BOUND: 4

RULE APPLICATION BOUND: 4

DISTINCT: checked

DOMAIN: 0,1,7,8,10,12,18,24-25

4. Computation

MAIN: continue

TWO STEPS IN ONE: checked

GENERATION LEVELS: 1-2

RULE APPLICATION BOUND: 4

DOMAIN: 0,1,7,8,10,12,18,24-25

DERIVATION: (for example) lc2.drv (in the directory docs/examples/lactone below the installation base)

The program should have found a synthesis!

To view the synthesis choose Open step in derivation from File in the Graphic Composer and enter lc1.drv in the directory docs/examples/lactone for the FILE WITH DERIVATION.

Proceed in the same way for the derivation lc2.drv.

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