AMBER Archive (2006)

Subject: AMBER: bond information

From: Fenghui Fan (fenghui_fan_at_yahoo.com)
Date: Sun Nov 26 2006 - 22:10:42 CST

Dear all,

As we know, when we use antechamber, sometimes we can
meet the bondtype problem, this is caused by the fact
that the the bond type cannot be judged.

As for the mol2file can give the correct atom type and
bond type, is anyway that we can combine the
antechamber and the mol2 file so that the bond type
judgement problem in antechamber will never occur?

Best regards.

Fenghui Fan

 
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