AMBER Archive (2003)

Subject: AMBER: gaff atom types for phosphor compouds

From: astrid.maass (astrid.maass_at_scai.fhg.de)
Date: Tue Dec 09 2003 - 07:51:33 CST

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Dear all,

Is it possible to model compounds like cationic PH4, pentavalent PCl5
and anionic PF6 with the gaff atom types?
Which atom types are appropriate?

Thank you for response,

best wishes

Astrid

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