[AMBER] What does ivalence set in PBSA?

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From: Matthew Guberman-Pfeffer via AMBER <amber.ambermd.org>
Date: Mon, 30 Oct 2023 11:47:26 -0400

Dear Amber community,

The ivalence keyword is used in Section 6.3.5 to compare Delphi to PBSA results, but I cannot find where the meaning of ivalence is explained. Can someone please describe (or point to a description) of this keyword?

Best,
Matthew

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Received on Mon Oct 30 2023 - 09:00:02 PDT