https://github.com/cran/rstpm2
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Tip revision: e222ff8dd84b3048627428eca87b667df51fc227 authored by Mark Clements on 09 October 2016, 09:19:38 UTC
version 1.3.4
Tip revision: e222ff8
c_optim.cpp
#include <Rcpp.h>
#include <R_ext/Applic.h>
#include <vector>
#include <map>
#include <float.h> /* DBL_EPSILON */
#include "c_optim.h"

// #include "uncmin.cpp"

namespace rstpm2 {

  using namespace Rcpp;

  double min(double a, double b) { return a < b ? a : b; }
  double max(double a, double b) { return a < b ? b : a; }
  double bound(double x, double lower, double upper) { return x < lower ? lower : (x > upper ? upper : x); }

  // print utilities
  void Rprint_(NumericMatrix m) {
    for (int i=0; i<m.nrow(); ++i) {
      for (int j=0; j<m.ncol(); ++j) 
	Rprintf("%f ", m(i,j));
      Rprintf("\n");
    }
  }
  void Rprint_(NumericVector v) {
    for (int i=0; i<v.size(); ++i) 
      Rprintf("%f ", v(i));
    Rprintf("\n");
  }

  // void nmmin(int n, double *Bvec, double *X, double *Fmin, optimfn fminfn,
  // 	   int *fail, double abstol, double intol, void *ex,
  // 	   double alpha, double bet, double gamm, int trace,
  // 	   int *fncount, int maxit)

  NelderMead::NelderMead(int trace, int maxit, 
			 double abstol, double reltol, 
			 double alpha, double beta, double gamma,
			 double epshess, bool hessianp) : 
      trace(trace), maxit(maxit), abstol(abstol), reltol(reltol), 
      alpha(alpha), beta(beta), gamma(gamma), epshess(epshess), hessianp(hessianp) { 
    }
  void NelderMead::optim(optimfn fn, NumericVector init, void * ex) {
    n = init.size();
    coef = clone(init);
    nmmin(n, &init[0], &coef[0], &Fmin, fn,
	    &fail, abstol, reltol, ex,
	    alpha, beta, gamma, trace,
	    &fncount, maxit);
      if (hessianp)
	hessian = calc_hessian(fn, ex);
    }
  NumericMatrix NelderMead::calc_hessian(optimfn fn, void * ex) {
      int n = coef.size();
      NumericMatrix hess(n,n);
      double tmpi,tmpj,f1,f0,fm1,hi,hj,fij,fimj,fmij,fmimj;
      f0 = fn(n,&coef[0],ex);
      for(int i=0; i<n; ++i) {
	tmpi = coef[i];
	hi = epshess*(1.0+std::abs(tmpi));
	coef[i] = tmpi + hi;
	f1=fn(n, &coef[0], ex);
	coef[i] = tmpi - hi;
	fm1=fn(n, &coef[0], ex);
	// hess(i,i) = (-f2 +16.0*f1 - 30.0*f0 + 16.0*fm1 -fm2)/(12.0*hi*hi);
	hess(i,i) = (f1 - 2.0*f0 + fm1)/(hi*hi);
	coef[i] = tmpi;
	for (int j=i; j<n; ++j) {
	  if (i != j) {
	    tmpj = coef[j];
	    hj = epshess*(1.0+std::abs(tmpj));
	    coef[i] = tmpi + hi;
	    coef[j] = tmpj + hj;
	    fij=fn(n, &coef[0], ex);
	    coef[i] = tmpi + hi;
	    coef[j] = tmpj - hj;
	    fimj=fn(n, &coef[0], ex);
	    coef[i] = tmpi - hi;
	    coef[j] = tmpj + hj;
	    fmij=fn(n, &coef[0], ex);
	    coef[i] = tmpi - hi;
	    coef[j] = tmpj - hj;
	    fmimj=fn(n, &coef[0], ex);
	    hess(j,i) = hess(i,j) = (fij-fimj-fmij+fmimj)/(4.0*hi*hj);
	    coef[i] = tmpi;
	    coef[j] = tmpj;
	  }
	}
      }
      return wrap(hess);
    }

  // void
  // vmmin(int n0, double *b, double *Fmin, optimfn fminfn, optimgr fmingr,
  //       int maxit, int trace, int *mask,
  //       double abstol, double reltol, int nREPORT, void *ex,
  //       int *fncount, int *grcount, int *fail)
  BFGS::BFGS(int trace, int maxit, 
	 double abstol,
	     double reltol, int report, double epshess, bool hessianp) : 
    trace(trace), maxit(maxit), report(report), abstol(abstol), reltol(reltol), epshess(epshess), hessianp(hessianp) { }
  void BFGS::optim(optimfn fn, optimgr gr, NumericVector init, void * ex) {
    n = init.size();
    std::vector<int> mask(n,1); 
    vmmin(n, &init[0], &Fmin, fn, gr, maxit, trace, &mask[0], abstol, reltol, report,
	  ex, &fncount, &grcount, &fail);
    coef = clone(init);
    if (hessianp)
      hessian = calc_hessian(gr, ex);
  }
  void BFGS::optim(int n, optimfn fn, optimgr gr, double *initptr, void * ex) {
    std::vector<int> mask(n,1); 
    vmmin(n, initptr, &Fmin, fn, gr, maxit, trace, &mask[0], abstol, reltol, report,
	  ex, &fncount, &grcount, &fail);
    coef = NumericVector(n);
    for (int i=0; i<n; ++i) coef[i] = initptr[i];
    if (hessianp)
      hessian = calc_hessian(gr, ex);
  }
  double BFGS::calc_objective(optimfn fn, NumericVector coef, void * ex) {
      return fn(coef.size(), &coef[0], ex);
    }
  double BFGS::calc_objective(optimfn fn, void * ex) {
      return fn(coef.size(), &coef[0], ex);
    }
  NumericMatrix BFGS::calc_hessian(optimgr gr, void * ex) {
      int n = coef.size();
      NumericVector df1(n);
      NumericVector df2(n);
      NumericMatrix hess(n,n);
      double tmp;
      for(int i=0; i<n; ++i) {
	tmp = coef[i];
	coef[i] = tmp + epshess;
	gr(n, &coef[0], &df1[0], ex);
	coef[i] = tmp - epshess;
	gr(n, &coef[0], &df2[0], ex);
	for (int j=0; j<n; ++j)
	  hess(i,j) = (df1[j] - df2[j]) / (2*epshess);
	coef[i] = tmp;
      }
      // now symmetrize
      for(int i=0; i<n; ++i) 
	for(int j=i; j<n; ++j) 
	  if (i != j)
	    hess(i,j) = hess(j,i) = (hess(i,j) + hess(j,i)) / 2.0;
      return wrap(hess); // wrap()?
    }


// void
// optif9(int nr, int n, double *x, fcn_p fcn, fcn_p d1fcn, d2fcn_p d2fcn,
//        void *state, double *typsiz, double fscale, int method,
//        int iexp, int *msg, int ndigit, int itnlim, int iagflg, int iahflg,
//        double dlt, double gradtl, double stepmx, double steptl,
//        double *xpls, double *fpls, double *gpls, int *itrmcd, double *a,
//        double *wrk, int *itncnt)
  Nlm::Nlm(double fscale,
	   int method,
	   int iexp,
	   int msg,
	   int ndigit,
	   int itnlim,
	   int iagflg,
	   int iahflg,
	   double dlt,
	   double gradtl, // cf. epshess
	   double stepmx,
	   double steptl,
     double epshess,
	   int itrmcd,
	   int itncnt,
	   bool hessianp
	   ) : fscale(fscale), method(method), iexp(iexp), msg(msg),
	       ndigit(ndigit), itnlim(itnlim), iagflg(iagflg), 
	       iahflg(iahflg), dlt(dlt), gradtl(gradtl), stepmx(stepmx),
	       steptl(steptl), epshess(epshess),
         itrmcd(itrmcd), itncnt(itncnt), hessianp(hessianp) { }
  void Nlm::optim(fcn_p fcn, fcn_p d1fcn, NumericVector init, void * state) {
      int n;
      n = init.size();
      std::vector<double> typsize(n,1.0), gpls(n,0.0), a(n*n,0.0), wrk(n*8,0.0);
      double norm, fpls;
      NumericVector xpls(n);
      // stepmax calculations
      if (stepmx == -1.0) {
	norm = 0.0;
	for (int i=0; i<n; ++i)
	  norm += init[i]*init[i]/typsize[i]/typsize[i];
	norm = sqrt(norm);
	stepmx = norm < 1.0 ? 1000.0 : norm*1000.0;
      }
      iagflg = 1; iahflg = 0;
      // call the optimizer
      optif9(n, n, &init[0], fcn, d1fcn, (d2fcn_p) 0, state, &typsize[0], fscale, method, 
	     iexp, &msg, ndigit, itnlim, iagflg, iahflg,
	     dlt, gradtl, stepmx, steptl,
	     &xpls[0], &fpls, &gpls[0], &itrmcd, &a[0],
	     &wrk[0], &itncnt);
      coef = clone(xpls);
      if (hessianp)
	hessian = calc_hessian(d1fcn, state);
    }
  void Nlm::optim(fcn_p fcn, NumericVector init, void * state) {
      int n;
      n = init.size();
      std::vector<double> typsize(n,1.0), gpls(n,0.0), a(n*n,0.0), wrk(n*8,0.0);
      double norm, fpls;
      NumericVector xpls(n);
      // stepmax calculations
      if (stepmx == -1.0) {
  norm = 0.0;
	for (int i=0; i<n; ++i)
	  norm += init[i]*init[i]/typsize[i]/typsize[i];
	norm = sqrt(norm);
	stepmx = norm < 1.0 ? 1000.0 : norm*1000.0;
      }
      iagflg = iahflg = 0;
      // call the optimizer
      optif9(n, n, &init[0], fcn, (fcn_p) 0, (d2fcn_p) 0, state, &typsize[0], fscale, method, 
	     iexp, &msg, ndigit, itnlim, iagflg, iahflg,
	     dlt, gradtl, stepmx, steptl,
	     &xpls[0], &fpls, &gpls[0], &itrmcd, &a[0],
	     &wrk[0], &itncnt);
      coef = clone(xpls);
      //if (hessianp)
	//hessian = calc_hessian(d1fcn, state);
    }
  double Nlm::calc_objective(fcn_p fn, NumericVector coef, void * ex) {
    double f;
    fn(coef.size(), &coef[0], &f, ex);
    return f;
  }
  double Nlm::calc_objective(fcn_p fn, void * ex) {
    double f;
    fn(coef.size(), &coef[0], &f, ex);
    return f;
  }
  NumericMatrix Nlm::calc_hessian(fcn_p gr, void * ex) {
      int n = coef.size();
      NumericVector df1(clone(coef));
      NumericVector df2(clone(coef));
      NumericMatrix hess(n,n);
      double tmp;
      for(int i=0; i<n; ++i) {
	tmp = coef[i];
	coef[i] += gradtl;
	gr(n, &coef[0], &df1[0], ex);
	coef[i] = tmp - gradtl;
	gr(n, &coef[0], &df2[0], ex);
	for (int j=i; j<n; ++j)
	  hess(j,i) = hess(i,j) = (df1[j] - df2[j]) / (2*gradtl);
	coef[i] = tmp;
      }
      return wrap(hess);
  }
  void Nlm::set_print_level(int print_level) {
    if (print_level == 0) msg = 9;
    if (print_level == 1) msg = 1;
    if (print_level >= 2) msg = 17;
  }

double Brent_fmin(double ax, double bx, double (*f)(double, void *),
		  void *info, double tol)
{
    /*  c is the squared inverse of the golden ratio */
    const double c = (3. - sqrt(5.)) * .5;

    /* Local variables */
    double a, b, d, e, p, q, r, u, v, w, x;
    double t2, fu, fv, fw, fx, xm, eps, tol1, tol3;

/*  eps is approximately the square root of the relative machine precision. */
    eps = DBL_EPSILON;
    tol1 = eps + 1.;/* the smallest 1.000... > 1 */
    eps = sqrt(eps);

    a = ax;
    b = bx;
    v = a + c * (b - a);
    w = v;
    x = v;

    d = 0.;/* -Wall */
    e = 0.;
    fx = (*f)(x, info);
    fv = fx;
    fw = fx;
    tol3 = tol / 3.;

/*  main loop starts here ----------------------------------- */

    for(;;) {
	xm = (a + b) * .5;
	tol1 = eps * fabs(x) + tol3;
	t2 = tol1 * 2.;

	/* check stopping criterion */

	if (fabs(x - xm) <= t2 - (b - a) * .5) break;
	p = 0.;
	q = 0.;
	r = 0.;
	if (fabs(e) > tol1) { /* fit parabola */

	    r = (x - w) * (fx - fv);
	    q = (x - v) * (fx - fw);
	    p = (x - v) * q - (x - w) * r;
	    q = (q - r) * 2.;
	    if (q > 0.) p = -p; else q = -q;
	    r = e;
	    e = d;
	}

	if (fabs(p) >= fabs(q * .5 * r) ||
	    p <= q * (a - x) || p >= q * (b - x)) { /* a golden-section step */

	    if (x < xm) e = b - x; else e = a - x;
	    d = c * e;
	}
	else { /* a parabolic-interpolation step */

	    d = p / q;
	    u = x + d;

	    /* f must not be evaluated too close to ax or bx */

	    if (u - a < t2 || b - u < t2) {
		d = tol1;
		if (x >= xm) d = -d;
	    }
	}

	/* f must not be evaluated too close to x */

	if (fabs(d) >= tol1)
	    u = x + d;
	else if (d > 0.)
	    u = x + tol1;
	else
	    u = x - tol1;

	fu = (*f)(u, info);

	/*  update  a, b, v, w, and x */

	if (fu <= fx) {
	    if (u < x) b = x; else a = x;
	    v = w;    w = x;   x = u;
	    fv = fw; fw = fx; fx = fu;
	} else {
	    if (u < x) a = u; else b = u;
	    if (fu <= fw || w == x) {
		v = w; fv = fw;
		w = u; fw = fu;
	    } else if (fu <= fv || v == x || v == w) {
		v = u; fv = fu;
	    }
	}
    }
    /* end of main loop */

    return x;
}


double R_zeroin2(			/* An estimate of the root */
    double ax,				/* Left border | of the range	*/
    double bx,				/* Right border| the root is seeked*/
    double fa, double fb,		/* f(a), f(b) */
    double (*f)(double x, void *info),	/* Function under investigation	*/
    void *info,				/* Add'l info passed on to f	*/
    double *Tol,			/* Acceptable tolerance		*/
    int *Maxit)				/* Max # of iterations */
{
    double a,b,c, fc;			/* Abscissae, descr. see above,  f(c) */
    double tol;
    int maxit;

    a = ax;  b = bx;
    c = a;   fc = fa;
    maxit = *Maxit + 1; tol = * Tol;

    /* First test if we have found a root at an endpoint */
    if(fa == 0.0) {
	*Tol = 0.0;
	*Maxit = 0;
	return a;
    }
    if(fb ==  0.0) {
	*Tol = 0.0;
	*Maxit = 0;
	return b;
    }

    while(maxit--)		/* Main iteration loop	*/
    {
	double prev_step = b-a;		/* Distance from the last but one
					   to the last approximation	*/
	double tol_act;			/* Actual tolerance		*/
	double p;			/* Interpolation step is calcu- */
	double q;			/* lated in the form p/q; divi-
					 * sion operations is delayed
					 * until the last moment	*/
	double new_step;		/* Step at this iteration	*/

	if( fabs(fc) < fabs(fb) )
	{				/* Swap data for b to be the	*/
	    a = b;  b = c;  c = a;	/* best approximation		*/
	    fa=fb;  fb=fc;  fc=fa;
	}
	tol_act = 2*DBL_EPSILON*fabs(b) + tol/2;
	new_step = (c-b)/2;

	if( fabs(new_step) <= tol_act || fb == (double)0 )
	{
	    *Maxit -= maxit;
	    *Tol = fabs(c-b);
	    return b;			/* Acceptable approx. is found	*/
	}

	/* Decide if the interpolation can be tried	*/
	if( fabs(prev_step) >= tol_act	/* If prev_step was large enough*/
	    && fabs(fa) > fabs(fb) ) {	/* and was in true direction,
					 * Interpolation may be tried	*/
	    register double t1,cb,t2;
	    cb = c-b;
	    if( a==c ) {		/* If we have only two distinct	*/
					/* points linear interpolation	*/
		t1 = fb/fa;		/* can only be applied		*/
		p = cb*t1;
		q = 1.0 - t1;
	    }
	    else {			/* Quadric inverse interpolation*/

		q = fa/fc;  t1 = fb/fc;	 t2 = fb/fa;
		p = t2 * ( cb*q*(q-t1) - (b-a)*(t1-1.0) );
		q = (q-1.0) * (t1-1.0) * (t2-1.0);
	    }
	    if( p>(double)0 )		/* p was calculated with the */
		q = -q;			/* opposite sign; make p positive */
	    else			/* and assign possible minus to	*/
		p = -p;			/* q				*/

	    if( p < (0.75*cb*q-fabs(tol_act*q)/2) /* If b+p/q falls in [b,c]*/
		&& p < fabs(prev_step*q/2) )	/* and isn't too large	*/
		new_step = p/q;			/* it is accepted
						 * If p/q is too large then the
						 * bisection procedure can
						 * reduce [b,c] range to more
						 * extent */
	}

	if( fabs(new_step) < tol_act) {	/* Adjust the step to be not less*/
	    if( new_step > (double)0 )	/* than tolerance		*/
		new_step = tol_act;
	    else
		new_step = -tol_act;
	}
	a = b;	fa = fb;			/* Save the previous approx. */
	b += new_step;	fb = (*f)(b, info);	/* Do step to a new approxim. */
	if( (fb > 0 && fc > 0) || (fb < 0 && fc < 0) ) {
	    /* Adjust c for it to have a sign opposite to that of b */
	    c = a;  fc = fa;
	}

    }
    /* failed! */
    *Tol = fabs(c-b);
    *Maxit = -1;
    return b;
}

  
  // R CMD INSTALL ~/src/R/microsimulation
  // R -q -e "require(microsimulation); .Call('test_nmmin',1:2,PACKAGE='microsimulation')"

  // .Call("optim_stpm2",init,X,XD,rep(bhazard,nrow(X)),wt,ifelse(event,1,0),package="rstpm2")

} // namespace rstpm2
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