NONMEM软件自定义模型

常用模块

一 、$PRED

二、PREDPP子程序

$MODEL

$MODEL定义模型房室数量和属性，以COMP语句命名各房室并定义其属性。

$MODEL
  COMP(DEPOT, DEFDOS)   ；定义吸收室，DEFDOS：default doseing compartment
  COMP(CENTRAL, DEFOBS) ；定义中央室，DEFOBS：default observation compartment
  COMP(PeripheralSHALLOW) ；定义周边室，浅
  COMP(PeripheralDEEP)    ；定义周边室，深

$SUBROUTINES

定义房室的数学关系，指定数学关系子程序

1. 通用线性模型
   ADVAN5和ADVAN7：一级速率转运室模块

示例：

$PROBLEM 3 CMT
$INPUT ID TIME AMT DV CMT EVID MDV 
$DATA 7-1.csv IGNORE=#
$SUBROUTINES ADVAN5
$MODEL
  COMP(DEPOT, DEFDOS)
  COMP(CENTRAL, DEFOBS)
  COMP(PeripheralSHALLOW)
  COMP(PeripheralDEEP)
$PK
 ;定义清除率和分布容积相关参数
  KA  = THETA(1)
  V2  = THETA(2) * EXP(ETA(1))
  CL  = THETA(3) * EXP(ETA(2))
  Q1  = THETA(4)
  Q2  = THETA(5) 
  V3  = THETA(6)
  V4  = THETA(7) 
; 定义ADVAN 5 & 7 的速率常数
  K12 = KA
  K20 = CL/V2
  K23 = Q1/V2
  K32 = Q1/V3
  K34 = Q2/V3
  K43 = Q2/V4 
$ERROR
 IPRED = F
 Y     = F * (1+ERR(1))
 IRES  = DV - IPRED
 DEL   = 0
 IF (DV .EQ. 0) DEL=1
 IWRES = (1-DEL) * IRES / (DV + DEL)
$THETA 
  (0,0.3)         ;KA
  (0,1.63)        ;V2
  (0,0.978)       ;CL
  15 FIXED      ;Q1
  10 FIXED      ;Q2
  40 FIXED