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Open-Systems-Pharmacology / PK-Sim

PK-Sim® is a comprehensive software tool for whole-body physiologically based pharmacokinetic modeling
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"Effective molecular weight" can become negative. #2900

Open PavelBal opened 6 months ago

PavelBal commented 6 months ago

Generic_PBPK_bug.zip

After I have changed some parameters in the "Advanced Parameters -> Particle Dissolution" section, creation of a simulation fails:

image

Even after I have reversed the parameter values to defaults.

PavelBal commented 6 months ago

Lol, no, the problem is that effective molecular weight can become negative!

image

Example - "Molecular weight" is 100 g/mol, and add 1 Br, 1 Cl, and 1 F halogen.