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Changes for page MLCE - PPIs prediction

Last modified by emacasali on 2023/01/11 16:04
From version 18.1
edited by emacasali
on 2023/01/11 15:50
Change comment: Uploaded new attachment "image-20230111155023-1.png", version {1}
To version 14.1
edited by emacasali
on 2023/01/11 15:47
Change comment: Uploaded new attachment "image-20230111154750-1.png", version {1}

Summary

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19 19  Mathematically speaking this process is an energy decomposition method, which starts with the calculation of the unbound part of the potential E (van der Waals, electrostatic interactions, solvent effects) through an MM/GBSA calculation:
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24 -Since the first eigenvector contains most of the relevant energy information about the interactions in the system, we can approximate the matrix energy to the first eigenvector:
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31 31  = Who has access? =
32 32  
33 33  Describe the audience of this collab.
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