Changes between Version 3 and Version 4 of AlkaneCreation

Timestamp:

Jun 17, 2011, 8:10:19 AM (14 years ago)

Author:

FrederikHeber

Comment:

added images

AlkaneCreation

@@ -1 +1 @@
 === Creating Arbitrary Alkanes ===
+
+[[Image(butane.png)]]
 
 This can also be used (in a somewhat unusual way) to generate alkanes of arbitrary length from a given one. Assume, we have a butane as given. We cut off the terminal hydrogens at either end and place them in files ''buildingblock_upper.xyz'' and  ''buildingblock_lower.xyz''.
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 }}}
 such that the first carbon atom is at "0,5,5".
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+[[Image(buildingblock_center.png)]]
 
 Then we may proceed as follows to produce a decane.
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 And finally, we have a complete decane molecule.
 
+[[Image(decane.png)]]
+
 Now, one may ask: Why not do this in a text editor? Of course, the duplication along with the translation of the periodic section is nice. Moreover however this approach can easily be placed in a script file and arbitrary alkanes can be produced by calling this script.