Thermodynamics constraints are rather important in metabolic modeling.
If not considered, they would lead to thermodynamically infeasible/implausible flux loops within flux sample.
Loopless space though is a non-convex one.
Approaches such as the LooplessFluxSampler could be used for more valid sampling from the biological point of view.
Thermodynamics constraints are rather important in metabolic modeling. If not considered, they would lead to thermodynamically infeasible/implausible flux loops within flux sample.
Loopless space though is a non-convex one. Approaches such as the
LooplessFluxSampler
could be used for more valid sampling from the biological point of view.Further literature: