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A repository for the scripts that I find useful when dealing with computational chemistry data from gaussian/turbomole/tinker etc packages. Some scripts are a lot cleaner/more user friendly than others. I will try to fix them when I have some time

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mdommett/compchem-scripts

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compchem-scripts

A repository for the scripts that I have written for dealing with computational chemistry data from gaussian/turbomole/tinker etc packages. Some scripts are a lot cleaner/more widely applicable/more user friendly than others.

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A repository for the scripts that I find useful when dealing with computational chemistry data from gaussian/turbomole/tinker etc packages. Some scripts are a lot cleaner/more user friendly than others. I will try to fix them when I have some time

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