I just started to think if in the academic version there is some limitation to batch calculation of pKa values. I have also lisence file in correct location.
jars by ticking "Extract archives to subfolders" I also have this free academic lisence but enabling these chemaxon properties seems quite difficult.Ĥ. I have been struggling with Chemaxon calculated properties. Less often used simulators include: Last Letter is a simpler simulator (fixed wing only) with lower CPU requirements than most other simulators. It currently has examples for multicopter and rover vehicles. Thanks for creating really great software! Webots is a cross-platform robotics simulator that is quick to set up and get running. I am sorry for the cumbersome stuff, but for obvious reasons I cannot send you a copy of the That file if you click right mouse on the DataWarrior icon, select 'Show Package Content' On linux this is in the file 'datawarrior'. The directory that contains datawarrior.jar and add all ChemAxon jar file names to the class If you are running Linux or OSX, you have a third option. If you are brave enough to go through this, I can send you the Linux scripts I used to create
#Webots academic lisence software#
Software uses heavily Class.forName() calls, whenever a molfile contains a specific feature. Which I added manually when the ClassNotFoundException was raised. The I noticed that different molfile/molecule features required additional classes to work, That gave me the core set of needed files. If not I undeleted theĮvidently necessary file and went to the next. The ChemAxon directory with checking whether OK.txt was written. Then I used a linux script to stepwise delete one file after another from
Java classpath to access the ChemAxon API from the unpacked folder with all ChemAxon classĪnd data files. Text file 'OK.txt' to indicate that the ChemAxon API worked correctly. I wrote a java program that used the ChemAxon API to create a ChemAxon Molecule objectįrom a molfile, to predict the pKa values, then checked the values and wrote an empty The approach that worked, is the following: I tried with two obfuscators to track dependencies and purge the rest. The problem: Locating the unneeded files is Results in a file that is less than 1Mbyte.
#Webots academic lisence zip#
The difficult one: Unpack all ChemAxon jar files into one directory, remove the file thatĪre not needed and zip the rest into one jar that you rename to 'capka.jar'.
The file will be more than 100Mbyte in size. This should work, but the disadvantage is that The easy one: Unpack all ChemAxon jar files into one directory and zip them again into oneīig jar that you rename to 'capka.jar'. If you want to do that, there are two options: If it finds this file and if it contains the needed Java classes, it will work. DataWarrior is looking for a file name 'capka.jar' in the same directory, where datawarrior.jar is located.
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