Equality-constrained solving problem, using

Inequality Constrained Problems To solve inequality constrained problems, a strategy is needed that can decide which of the inequality constraints should be treated as equalities. Once that question is decided, a GRG type of approach can be used to solve the resulting equality constrained problem. Solving can be split into two phases phase 1, where the go is to find a point that is feasible with respec t to the inequality constraints and phase 2, where one seeks the optimum while maintaining feasibility. Phase 1 is often accomphshed by ignoring the objective function and using instead... 

Further Comments on General Programming.—This section will utilize ideas developed in linear programming. The use of Lagrange multipliers provides one method for solving constrained optimization problems in which the constraints are given as equalities. 

In summary, condition 1 gives a set of n algebraic equations, and conditions 2 and 3 give a set of m constraint equations. The inequality constraints are converted to equalities using h slack variables. A total of M + m constraint equations are solved for n variables and m Lagrange multipliers that must satisfy the constraint qualification. Condition 4 determines the value of the h slack variables. This theorem gives an indirect problem in which a set of algebraic equations is solved for the optimum of a constrained optimization problem. 

The augmented Lagrangian method is not the only approach to solving constrained optimization problems, yet a complete discussion of this subject is beyond the scope of this text. We briefly consider a popular, and efficient, class of methods, as it is used by fmincon, sequential quadratic programming (SQP). We wUl find it useful to introduce a common notation for the equality and inequality constraints using slack variables. 

An approach to solving the inverse Fourier problem is to reconstruct a parametrized spin density based on axially symmetrical p orbitals (pz orbitals) centered on all the atoms of the molecule (wave function modeling). In the model which was actually used, the spin populations of corresponding atoms of A and B were constrained to be equal. The averaged populations thus refined are displayed in Table 2. Most of the spin density lies on the 01, N1 and N2 atoms. However, the agreement obtained between observed and calculated data (x2 = 2.1) indicates that this model is not completely satisfactory. 

When solving an inequality-constrained optimal control problem numerically, it is impossible to determine which constraints are active. The reason is one cannot obtain a p, exactly equal to zero. This difficulty is surmounted by considering a constraint to be active if the corresponding p < a where a is a small positive number such as 10 or less, depending on the problem. Slack variables may be used to convert inequalities into equalities and utilize the Lagrange Multiplier Rule. 

Alternatively, increasing penalties may be applied on constraint violations during repeated applications of any computational algorithm used for unconstrained problems. We will use the latter approach in Chapter 7 to solve optimal control problems constrained by (in)equalities. 

As mentioned earlier, the developed algorithm employs dynopt to solve the intermediate problems associated with the local interaction of the agents. Specifically, dynopt is a set of MATLAB functions that use the orthogonal collocation on finite elements method for the determination of optimal control trajectories. As inputs, this toolbox requires the dynamic process model, the objective function to be minimized, and the set of equality and inequality constraints. The dynamic model here is described by the set of ordinary differential equations and differential algebraic equations that represent the fermentation process model. For the purpose of optimization, the MATLAB Optimization Toolbox, particularly the constrained nonlinear rninimization routine fmincon [29], is employed. 

This is a typical minimization problem for a function of n variables that can be solved using a Mathcad built-in function MINIMIZE. The latter implements gradient search algorithms to find the local minimum. The SSq function in this case is called the target function, and the unknown kinetic constants are the optimization parameters. When there are no additional limitations for the values of optimization parameters or the sought function, we have a case of the so called unconstrained optimization. Likewise, if the unknown parameters or the target function itself are mathematically constrained with some equalities or inequalities, then one deals with the constrained optimization. Such additional constrains are usually set on the basis on the physical nature of the problems (e.g. rate constants must be positive, a ratio of the direct reaction rate to that of the inverse one must equal the equilibrium constant, etc.) The constraints are sometimes added in order to speed up the computations (for example, the value of target function in the found minimum should not exceed some number TOL). 

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