[Users-list] site points from FLAP into a readable format

[anna.vulpetti at novartis.com]

Dear moldiscovery user list,

I would like to get the coordinates of selected MIF points (e.g., the 
points with lower energy) in a readable format.
The Chapter 62. GLUE Tutorial 02 section is giving very useful information 
on how generate these 'site points'.
These points are collected in files named file_probes.mini(e.g., 
1LIC_SO2_in_DRY.mini of the tutorial).

But hese files are not readable.
Do you know how to convert these files in readable coordinates (e.g. in 
pdb or whatever other format to be able to import them in other programs)?

As an attempt I have tryied to run the k2f routine on these file (routine 
which converts kont in asci format). It does not work.

I would appreciate your help,
Best Regards,
Anna

_____________________________________
Anna Vulpetti, Ph.D.
Computer Aided Drug Design,
WSJ-507.5.52
Novartis Pharma AG
Forum 1
Novartis Campus
CH-4056 Basel 
Phone: +41 61 32 41016
Email: anna.vulpetti at novartis.com
______________________________________
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