Dear all,
As you may know, somes features can be added to a mol2 file created with
sybyl.
There are some classical features such as those beginning with
.<TRIPOS>MOLECULE or .<TRIPOS>ATOM.
And there are some optional features (.<TRIPOS>SET or .<TRIPOS>NORMAL).
These optional blocks are not a problem for tleap, but with sleap I got
the following message:
Unknow sybyl keyword <TRIPOS>NORMAL
Or
Unknow sybyl keyword <TRIPOS>SET
Then sleap stops.
Is it a reported bug of sleap?
This problem is a pity because I have to delete these blocks in my files
before loading them in sleap.
Regards,
G.GUENEGOU
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Received on Tue Jun 28 2011 - 02:30:03 PDT
