On 13/12/2011 4:55 PM, Nishith Saurav Topno wrote:
Dear all,
i need to add 8 positive ions to my system..its a membrane protein
enveloped inside a solvent box..when i am running the genion command
for addition of 8 positive ions to the system, its showing an error "
your solvent group size (6173) is not a multiple of 11"...what does
this mean...??... how can i rectify this error??...plz help
genion has to remove solvent molecules (IIRC named SOL) from your
system, but the contents of your [molecules] directive and/or coordinate
file don't make sense to genion.
Mark
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