Re: NAMD 2.9 Changing/Replacing atoms in multiple molecules

From: Kenno Vanommeslaeghe (
Date: Fri Feb 21 2014 - 12:38:25 CST

On 02/21/2014 09:11 AM, Axel Kohlmeyer wrote:
> of course, you have to look up details in the force field
> documentation, because you may have to also change the force field
> type and (partial) charge of neighboring atoms.

Yeah, depending on details we haven't been given, this last part can get
fairly tricky.

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