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[Question]: unable to understand the results #518
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Please, check this page |
I have obtained this result but not getting the results same as it. can you
please help
…On Sun, Jul 14, 2024 at 4:46 AM Mario Sergio Valdés Tresanco < ***@***.***> wrote:
Please, check this page
<https://valdes-tresanco-ms.github.io/gmx_MMPBSA/dev/output/>
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Please, attach the result via GitHub since responses via email did not include the attachment |
LIG2_FINAL_RESULTS_MMPBSA.csv |
Well, you can get a summary result in the *.dat file, which is explained in the documentation. |
we need to calculate it manually? |
No. This is the default output file which is always generated and it is a summary of the calculation. With this file, you can see what happeng in the calculation. All the terms are represented by the average, SD, etc. The csv files (they are optional, and must be defined as |
Not able to understand from the tutorial video available on the main site, how to analyze from the gmx_MMPBSA_ana. Is any other tutorial video is availabe of using the ana programm |
My Question is...
i have obtained the .dat and .csv file bt not understanding how to compile the results?
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