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chandkc / X-ESS

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RMSD results same for whole protein and binding site #37

Closed aiswaryapawar closed 2 years ago

aiswaryapawar commented 2 years ago

Ubuntu machine-PIPL03 exe- Test_V2_4(shared on sep2)

Ran complex and apo simulations, and the RMSD results for both complex and apo for whole protein and the binding site look the same.

Screen Shot 2022-09-05 at 6 52 34 PM Screen Shot 2022-09-05 at 6 52 43 PM
chandkc commented 2 years ago

@LobeliaG In the maunal, please advise the user to use a shorter file name when they upload the complex. If not, the plots would look as above.

LobeliaG commented 2 years ago

@LobeliaG In the maunal, please advise the user to use a shorter file name when they upload the complex. If not, the plots would look as above.

okay sir

prescienceit commented 2 years ago

Fixed