more sweep removal and repair.

[CommonLispStat.git] / src / stat-models / regression.lisp

;;; -*- mode: lisp -*-
;;;
;;; Copyright (c) 2008--, by A.J. Rossini <blindglobe@gmail.com>
;;; See COPYRIGHT file for any additional restrictions (BSD license).
;;; Since 1991, ANSI was finally finished.  Modified to match ANSI
;;; Common Lisp.  

;;;; Originally from:
;;;; regression.lsp XLISP-STAT regression model proto and methods
;;;; XLISP-STAT 2.1 Copyright (c) 1990, by Luke Tierney
;;;; Additions to Xlisp 2.1, Copyright (c) 1989 by David Michael Betz
;;;; You may give out copies of this software; for conditions see the file
;;;; COPYING included with this distribution.
;;;;
;;;; Incorporates modifications suggested by Sandy Weisberg.

;;; This version uses lisp-matrix for underlying numerics.

(in-package :lisp-stat-regression-linear)

;;; Regresion Model Prototype

;; The general strategy behind the fitting of models using prototypes
;; is that we need to think about want the actual fits are, and then
;; the fits can be used to recompute as components are changes.  One
;; catch here is that we'd like some notion of trace-ability, in
;; particular, there is not necessarily a fixed way to take care of the
;; audit trail.  save-and-die might be a means of recording the final
;; approach, but we are challenged by the problem of using advice and
;; other such features to capture stages and steps that are considered
;; along the goals of estimating a model.

;; Note that the above is a stream-of-conscience response to the
;; challenge of reproducibility in the setting of prototype "on-line"
;; computation. 

(defvar regression-model-proto nil
  "Prototype for all regression model instances.")

(defproto regression-model-proto
    '(x y intercept betahat basis weights 
      included
      total-sum-of-squares
      residual-sum-of-squares
      predictor-names
      response-name
      case-labels
      doc)
  ()
  *object*
  "Normal Linear Regression Model")




(defun xtxinv (x)
  "In: X
   Out: (XtX)^-1 

X is NxP, so result is PxP.  Represents Var[\hat\beta], the vars for
\hat \beta from Y = X \beta + \eps.  Done by Cholesky decomposition,
using LAPACK's dpotri routine to invert, after factorizing with dpotrf.

<example>
  (let ((m1 (rand 7 5)))
     (xtxinv m1))
</example>"
  (check-type x matrix-like)
  (minv-cholesky (m* (transpose x) x)))


;; might add args: (method 'gelsy), or do we want to put a more
;; general front end, linear-least-square, across the range of
;; LAPACK solvers? 
(defun lm (x y &optional rcond (intercept T))
  "fit the linear model:
           y = x \beta + e 

and estimate \beta.  X,Y should be in cases-by-vars form, i.e. X
should be n x p, Y should be n x 1.  Returns estimates, n and p.
Probably should return a form providing the call, as well.

R's lm object returns: coefficients, residuals, effects, rank, fitted,
qr-results for numerical considerations, DF_resid.  Need to
encapsulate into a class or struct."
    (check-type x matrix-like)
    (check-type y vector-like)          ; vector-like might be too strict?
                                        ; maybe matrix-like?
    (assert (= (nrows y) (nrows x)) ; same number of observations/cases
            (x y) "Can not multiply x:~S by y:~S" x y)
    (let ((x1 (if intercept
                  (bind2 (ones (matrix-dimension x 0) 1)
                         x :by :column)
                  x)))
      (let ((betahat (gelsy (m* (transpose x1) x1)
                            (m* (transpose x1) y)
                            (if rcond rcond (*
                                             (coerce (expt 2 -52) 'double-float)
                                             (max (nrows x1)
                                                  (ncols y))))))
            (betahat1 (gelsy x1
                             y
                             (if rcond rcond
                                  (* (coerce (expt 2 -52) 'double-float)
                                     (max (nrows x1)
                                          (ncols y)))))))
        ;; need computation for SEs, 
        (format t "")
        (list betahat  ; LA-SIMPLE-VECTOR-DOUBLE
              betahat1 ; LA-SLICE-VECVIEW-DOUBLE
              (xtxinv x1); (sebetahat betahat x y) ; TODO: write me!
              (nrows x)  ; surrogate for n
              (ncols x1) ; surrogate for p
              ;; (v- (first betahat) (first betahat1))
              ))))




(defun regression-model
    (x y &key 
     (intercept T) 
     (print T) 
     (weights nil)
     (included (repeat t (vector-dimension y)))
     predictor-names
     response-name
     case-labels
     (doc "Undocumented Regression Model Instance")
     (debug T))
  "Args: (x y &key (intercept T) (print T) (weights nil)
          included predictor-names response-name case-labels)
X           - list of independent variables or X matrix
Y           - dependent variable.
INTERCEPT   - T to include (default), NIL for no intercept
PRINT       - if not NIL print summary information
WEIGHTS     - if supplied should be the same length as Y; error
              variances are  
              assumed to be inversely proportional to WEIGHTS
PREDICTOR-NAMES, RESPONSE-NAME, CASE-LABELS
            - sequences of strings or symbols.
INCLUDED    - if supplied should be the same length as Y, with
              elements nil to skip a in computing estimates (but not
              in residual analysis).
Returns a regression model object. To examine the model further assign the
result to a variable and send it messages.
Example (data are in file absorbtion.lsp in the sample data directory): 
  (def m (regression-model (list iron aluminum) absorbtion))
  (send m :help) (send m :plot-residuals)"
  (let ((x (cond 
             ((typep x 'matrix-like) x)
#| assume only numerical vectors -- but we need to ensure coercion to float.
             ((or (typep x 'sequence) 
                  (and (consp x)
                       (numberp (car x)))
                  (make-vector (length x) :initial-contents x)))
|#
             (t (error "not matrix-like.");x
                ))) ;; actually, might should barf.
        (y (cond
             ((typep y 'vector-like) y)
#|
             ((and (consp x)
                   (numberp (car x))) (make-vector (length y) :initial-contents y))
|#
             (t (error "not vector-like."); y
                ))) ;; actually, might should barf.
        (m (send regression-model-proto :new)))
    (format t "~%")
    (send m :doc doc)
    (send m :x x)
    (send m :y y)
    (send m :intercept intercept)
    (send m :weights weights)
    (send m :included included)
    (send m :predictor-names predictor-names)
    (send m :response-name response-name)
    (send m :case-labels case-labels)
    (if debug
        (progn
          (format t "~%")
          (format t "~S~%" (send m :doc))
          (format t "X: ~S~%" (send m :x))
          (format t "Y: ~S~%" (send m :y))))
    (if print (send m :display))
    m))




(defmeth regression-model-proto :isnew ()
  (send self :needs-computing t))

(defmeth regression-model-proto :save ()
"Message args: ()
Returns an expression that will reconstruct the regression model."
  `(regression-model ',(send self :x)
                     ',(send self :y)
                     :intercept ',(send self :intercept)
                     :weights ',(send self :weights)
                     :included ',(send self :included)
                     :predictor-names ',(send self :predictor-names)
                     :response-name ',(send self :response-name)
                     :case-labels ',(send self :case-labels)))
                       
;;; Computing and Display Methods

;; [X|Y]t [X|Y]
;; = XtX  XtY
;;   YtX  YtY
;; so with (= (dim X) (list n p))
;; we end up with p x p   p x 1
;;                1 x p   1 x 1
;;
;; and this can be implemented by
#|
  (setf XY (bind2 X Y :by :row))
  (setf XYtXY (m* (transpose XY) XY))
|#
;; which is too procedural.  Sigh, I meant
#|
  (setf XYtXY (let ((XY (bind2 X Y :by :row)))
                 (m*  (transpose XY) XY)))
|#
;; which at least looks lispy.

(defmeth regression-model-proto :compute ()
"Message args: ()
Recomputes the estimates. For internal use by other messages"
  (let* ((included (if-else (send self :included) 1d0 0d0))
         (x (send self :x))
         (y (send self :y))
         (intercept (send self :intercept)) ;; T/nil
         (weights (send self :weights)) ;; vector-like or nil
         (w (if weights (* included weights) included))
         (n (matrix-dimension x 0))
         (p (if intercept
                (1- (matrix-dimension x 1))
                (matrix-dimension x 1))) ;; remove intercept from # params -- right?
         (tss 0)
         (res 0 ;  (compute-residuals y yhat)
           )
         (tol 0.000001 
           ;;  (* 0.001 (reduce #'* (mapcar #'standard-deviation (list-of-columns x))))
          ))
    (format t
            "~%REMOVEME: regr-mdl-prto :compute~%x= ~A~%y= ~A~% tss= ~A~% tol= ~A~%  w= ~A~% n= ~A~%  p= ~A~%"
           x y tss tol w n p )

    ;; (send self :beta-coefficents (lm x y)) ;; FIXME!
    (send self :xtxinv (xtxinv x)) 

    (setf (slot-value 'total-sum-of-squares) tss)
    (setf (slot-value 'residual-sum-of-squares) 
          (m* (ones 1 n) (v* res res)))))

(defmeth regression-model-proto :needs-computing (&optional set)
"Message args: ( &optional set )

If value given, sets the flag for whether (re)computation is needed to
update the model fits."  
   (send self :nop)
   (if set (setf (slot-value 'beta-hat) nil))
   (null (slot-value 'beta-hat)))
  
(defmeth regression-model-proto :display ()
"Message args: ()

Prints the least squares regression summary. Variables not used in the fit
are marked as aliased."
  (let ((coefs (coerce (send self :coef-estimates) 'list))
        (se-s (send self :coef-standard-errors))
        (x (send self :x))
        (p-names (send self :predictor-names)))
    (if (send self :weights) 
        (format t "~%Weighted Least Squares Estimates:~2%")
        (format t "~%Least Squares Estimates:~2%"))
    (when (send self :intercept)
          (format t "Constant               ~10f   ~A~%"
                  (car coefs) (list (car se-s)))
          (setf coefs (cdr coefs))
          (setf se-s (cdr se-s)))
    (dotimes (i (array-dimension x 1)) 
             (cond 
               ((member i (send self :basis))
                (format t "~22a ~10f   ~A~%"
                        (select p-names i) (car coefs) (list (car se-s)))
                (setf coefs (cdr coefs) se-s (cdr se-s)))
               (t (format t "~22a    aliased~%" (select p-names i)))))
    (format t "~%")
    (format t "R Squared:             ~10f~%" (send self :r-squared))
    (format t "Sigma hat:             ~10f~%" (send self :sigma-hat))
    (format t "Number of cases:       ~10d~%" (send self :num-cases))
    (if (/= (send self :num-cases) (send self :num-included))
        (format t "Number of cases used:  ~10d~%" (send self :num-included)))
    (format t "Degrees of freedom:    ~10d~%" (send self :df))
    (format t "~%")))

;;; Slot accessors and mutators

(defmeth regression-model-proto :doc (&optional new-doc append)
"Message args: (&optional new-doc)

Returns the DOC-STRING as supplied to m.  
Additionally, with an argument NEW-DOC, sets the DOC-STRING to
NEW-DOC.  In this setting, when APPEND is T, don't replace and just
append NEW-DOC to DOC."
  (send self :nop)
  (when (and new-doc (stringp new-doc))
    (setf (slot-value 'doc)
          (if append
              (concatenate 'string
                           (slot-value 'doc)
                           new-doc)
              new-doc)))
  (slot-value 'doc))


(defmeth regression-model-proto :x (&optional new-x)
"Message args: (&optional new-x)

With no argument returns the x matrix-like as supplied to m. With an
argument, NEW-X sets the x matrix-like to NEW-X and recomputes the
estimates."
  (when (and new-x (typep new-x 'matrix-like))
    (setf (slot-value 'x) new-x)
    (send self :needs-computing t))
  (slot-value 'x))

(defmeth regression-model-proto :y (&optional new-y)
"Message args: (&optional new-y)

With no argument returns the y vector-like as supplied to m. With an
argument, NEW-Y sets the y vector-like to NEW-Y and recomputes the
estimates."
  (when (and new-y
             (typep new-y 'vector-like))
    (setf (slot-value 'y) new-y) ;; fixme -- pls set slot value to a vector-like!
    (send self :needs-computing t))
  (slot-value 'y))

(defmeth regression-model-proto :intercept (&optional (val nil set))
"Message args: (&optional new-intercept)

With no argument returns T if the model includes an intercept term,
nil if not. With an argument NEW-INTERCEPT the model is changed to
include or exclude an intercept, according to the value of
NEW-INTERCEPT."
  (when set 
    (setf (slot-value 'intercept) val)
    (send self :needs-computing t))
  (slot-value 'intercept))

(defmeth regression-model-proto :weights (&optional (new-w nil set))
"Message args: (&optional new-w)

With no argument returns the weight vector-like as supplied to m; NIL
means an unweighted model. NEW-W sets the weights vector-like to NEW-W
and recomputes the estimates."
  (when set
#|    ;; probably need to use "check-type" or similar?
      (and set nil
           (or (= new-w nil)
               (typep new-w 'vector-like)))
|#
    (setf (slot-value 'weights) new-w) 
    (send self :needs-computing t))
  (slot-value 'weights))

(defmeth regression-model-proto :total-sum-of-squares ()
"Message args: ()

Returns the total sum of squares around the mean.
This is recomputed if an update is needed."
  (if (send self :needs-computing)
      (send self :compute))
  (slot-value 'total-sum-of-squares))

(defmeth regression-model-proto :residual-sum-of-squares () 
"Message args: ()

Returns the residual sum of squares for the model.
This is recomputed if an update is needed."
  (if (send self :needs-computing)
      (send self :compute))
  (slot-value 'residual-sum-of-squares))

(defmeth regression-model-proto :basis ()
"Message args: ()

Returns the indices of the variables used in fitting the model, in a
sequence.
This is recomputed if an update is needed."
  (if (send self :needs-computing)
      (send self :compute))
  (slot-value 'basis))
  
(defmeth regression-model-proto :included (&optional new-included)
"Message args: (&optional new-included)

With no argument, NIL means a case is not used in calculating
estimates, and non-nil means it is used.  NEW-INCLUDED is a sequence
of length of y of nil and t to select cases.  Estimates are
recomputed."
  (when new-included
#|
    (and new-included 
         (= (length new-included) (send self :num-cases)))
|#
        (setf (slot-value 'included) (copy-seq new-included)) 
        (send self :needs-computing t))
  (if (slot-value 'included)
      (slot-value 'included)
      (repeat t (send self :num-cases))))

(defmeth regression-model-proto :predictor-names (&optional (names nil set))
"Message args: (&optional (names nil set))

With no argument returns the predictor names. NAMES sets the names."
  (if set (setf (slot-value 'predictor-names) (mapcar #'string names)))
  (let ((p (matrix-dimension (send self :x) 1))
        (p-names (slot-value 'predictor-names)))
    (if (not (and p-names (= (length p-names) p)))
        (setf (slot-value 'predictor-names)
              (mapcar #'(lambda (a) (format nil "Variable ~a" a)) 
                      (iseq 0 (- p 1))))))
  (slot-value 'predictor-names))

(defmeth regression-model-proto :response-name (&optional (name "Y" set))
   "Message args: (&optional name)

With no argument returns the response name. NAME sets the name."
   (send self :nop)
   (if set (setf (slot-value 'response-name) (if name (string name) "Y")))
   (slot-value 'response-name))

(defmeth regression-model-proto :case-labels (&optional (labels nil set))
"Message args: (&optional labels)
With no argument returns the case-labels. LABELS sets the labels."
  (if set (setf (slot-value 'case-labels) 
                (if labels 
                    (mapcar #'string labels)
                    (mapcar #'(lambda (x) (format nil "~d" x)) 
                            (iseq 0 (- (send self :num-cases) 1))))))
  (slot-value 'case-labels))

;;;
;;; Other Methods
;;; None of these methods access any slots directly.
;;;

(defmeth regression-model-proto :num-cases ()
"Message args: ()
Returns the number of cases in the model."
  (nelts (send self :y))) ; # cases in data, must accomodate weights or masking!

(defmeth regression-model-proto :num-included ()
"Message args: ()
Returns the number of cases used in the computations."
  (sum (if-else (send self :included) 1 0)))

(defmeth regression-model-proto :num-coefs ()
"Message args: ()
Returns the number of coefficients in the fit model (including the
intercept if the model includes one)."
  (if (send self :intercept)
      (+ 1 (nelts (send self :basis)))
      (nelts (send self :basis))))

(defmeth regression-model-proto :df ()
"Message args: ()
Returns the number of degrees of freedom in the model."
  (- (send self :num-included) (send self :num-coefs)))
  
(defmeth regression-model-proto :x-matrix ()
"Message args: ()
Returns the X matrix for the model, including a column of 1's, if
appropriate. Columns of X matrix correspond to entries in basis."
  (let ((m (select (send self :x) 
                   (iseq 0 (- (send self :num-cases) 1)) 
                   (send self :basis))))
    (if (send self :intercept)
        (bind2 (repeat 1 (send self :num-cases)) m)
        m)))

(defmeth regression-model-proto :leverages ()
"Message args: ()
Returns the diagonal elements of the hat matrix."
  (let* ((weights (send self :weights))
         (x (send self :x-matrix))
         (raw-levs 
          (m* (* (m* x (send self :xtxinv)) x)
              (repeat 1 (send self :num-coefs)))))
    (if weights (* weights raw-levs) raw-levs)))

(defmeth regression-model-proto :fit-values ()
"Message args: ()
Returns the fitted values for the model."
  (m* (send self :x-matrix) (send self :coef-estimates)))

(defmeth regression-model-proto :raw-residuals () 
"Message args: ()
Returns the raw residuals for a model."
  (- (send self :y) (send self :fit-values)))

(defmeth regression-model-proto :residuals () 
"Message args: ()
Returns the raw residuals for a model without weights. If the model
includes weights the raw residuals times the square roots of the weights
are returned."
  (let ((raw-residuals (send self :raw-residuals))
        (weights (send self :weights)))
    (if weights (* (sqrt weights) raw-residuals) raw-residuals)))

(defmeth regression-model-proto :sum-of-squares () 
"Message args: ()
Returns the error sum of squares for the model."
  (send self :residual-sum-of-squares))

(defmeth regression-model-proto :sigma-hat ()
"Message args: ()
Returns the estimated standard deviation of the deviations about the 
regression line."
  (let ((ss (send self :sum-of-squares))
        (df (send self :df)))
    (if (/= df 0) (sqrt (/ ss df)))))

;; for models without an intercept the 'usual' formula for R^2 can give
;; negative results; hence the max.
(defmeth regression-model-proto :r-squared ()
"Message args: ()
Returns the sample squared multiple correlation coefficient, R squared, for
the regression."
  (max (- 1 (/ (send self :sum-of-squares) (send self :total-sum-of-squares)))
       0))

(defmeth regression-model-proto :coef-estimates ()
"Message args: ()

Returns the OLS (ordinary least squares) estimates of the regression
coefficients. Entries beyond the intercept correspond to entries in
basis."
  (let ((n (matrix-dimension (send self :x) 1))
        (indices (flatten-list
                  (if (send self :intercept) 
                     (cons 0 (+ 1 (send self :basis)))
                     (list (+ 1 (send self :basis))))))
        (x (send self :x)))
    (format t "~%REMOVEME2: Coef-ests: ~% Sweep Matrix: ~A ~% array dim 1: ~A ~% Swept indices:  ~A ~% basis: ~A"
            x n indices (send self :basis))
    (coerce (compound-data-seq (select m (1+ n) indices)) 'list))) ;; ERROR

(defmeth regression-model-proto :xtxinv () 
   "Message args: ()
Returns ((X^T) X)^(-1) or ((X^T) W X)^(-1)."
  (xtxinv (send self x)))

(defmeth regression-model-proto :coef-standard-errors ()
"Message args: ()
Returns estimated standard errors of coefficients. Entries beyond the
intercept correspond to entries in basis."
  (let ((s (send self :sigma-hat)))
    (if s (* (send self :sigma-hat) (sqrt (diagonalf (send self :xtxinv)))))))

(defmeth regression-model-proto :studentized-residuals ()
"Message args:  ()
Computes the internally studentized residuals for included cases and externally studentized residuals for excluded cases."
  (let ((res (send self :residuals))
        (lev (send self :leverages))
        (sig (send self :sigma-hat))
        (inc (send self :included)))
    (if-else inc
             (/ res (* sig (sqrt (max .00001 (- 1 lev))))) ; vectorize max
             (/ res (* sig (sqrt (+ 1 lev)))))))

(defmeth regression-model-proto :externally-studentized-residuals ()
"Message args:  ()
Computes the externally studentized residuals."
  (let* ((res (send self :studentized-residuals))
         (df (send self :df)))
    (if-else (send self :included)
             (* res (sqrt (/ (- df 1) (- df (v* res res)))))
             res)))

(defmeth regression-model-proto :cooks-distances ()
"Message args: ()
Computes Cook's distances."
  (let ((lev (send self :leverages))
        (res (/ (v* (send self :studentized-residuals)
                    (send self :studentized-residuals))
                (send self :num-coefs))))
    (if-else (send self :included) (* res (/ lev (- 1 lev) )) (* res lev))))

#|
 (defun plot-points (x y &rest args)
  "need to fix."
  (error "Graphics not implemented yet."))
|#


#|
;; Can not plot points yet!!
 (defmeth regression-model-proto :plot-residuals (&optional x-values)
"Message args: (&optional x-values)
Opens a window with a plot of the residuals. If X-VALUES are not supplied 
the fitted values are used. The plot can be linked to other plots with the 
link-views function. Returns a plot object."
  (plot-points (if x-values x-values (send self :fit-values))
               (send self :residuals)
               :title "Residual Plot"
               :point-labels (send self :case-labels)))
|#

#|
 (defmeth regression-model-proto :plot-bayes-residuals 
  (&optional x-values)
  "Message args: (&optional x-values)

Opens a window with a plot of the standardized residuals and two
standard error bars for the posterior distribution of the actual
deviations from the line. See Chaloner and Brant. If X-VALUES are not
supplied the fitted values are used. The plot can be linked to other
plots with the link-views function.  Returns a plot object."

  (let* ((r (/ (send self :residuals)
               (send self :sigma-hat)))
         (d (* 2 (sqrt (send self :leverages))))
         (low (- r d))
         (high (+ r d))
         (x-values (if x-values x-values (send self :fit-values)))
         (p (plot-points x-values r
                         :title "Bayes Residual Plot"
                         :point-labels (send self :case-labels))))
    (map 'list #'(lambda (a b c d) (send p :plotline a b c d nil))
         x-values low x-values high)
    (send p :adjust-to-data)
    p))
|#

;;;; Other code

#|
  (defun print-lm (lm-obj)
    "transcribed from R"
    (p (rank lm-obj)
    (when (= p 0) 
      ;; EVIL LOGIC!  Just to store for now.
      (let ()
            (n (length (residuals lm-obj)))
            (w (if (weights lm-obj)
                   (weights lm-obj)
                   (ones n 1)))
            (r  (if (weights lm-obj)
                      (residuals lm-obj)
                      (v.* (residuals lm-obj)
                           (mapcar #'sqrt (weights lm-obj)))))
            (rss (sum (v.* r r)))
            (resvar (/ rss (- n p)))
            ;; then answer, to be encapsulated in a struct/class
            ;; instance, 
            (aliased (is.na (coef lm-obj)))
            (residuals r)
            (df (list 0 n (length aliased)))
            (coefficients (list 'NA 0d0 4d0))o
            (sigma (sqrt resvar))
            (r.squared 0d0)
            (adj.r.squared 0d0)))
      )
    ;;otherwise...
    (when (not (= p 0))
      (let ((n (nrows (qr lm-obj)))
            (rdf  (- n p))
            ))))

  (lm *xv+1* *y2*)
  (lm (transpose *xv*) *y2*)

  (princ "Linear Models Code setup")

|#