Update TEF stuff

DESCRIPTION

@@ -26,6 +26,7 @@ Imports:
   dplyr,
   flexsurv,
   lattice,
+  lifecycle,
   lme4,
   lubridate,
   magrittr,
@@ -38,6 +39,7 @@ Imports:
   pbapply,
   readr,
   readxl,
+  rlang,
   sf,
   stringr,
   survival,

R/import_check_functions.R

@@ -513,11 +513,29 @@ ctsm.check.unit.biota <- function(data, info) {
     })
 
   id <- data$determinand %in% "TEQDFP"
-  if (any(id))
+  if (any(id)) {
+
+    TEQ_unit <- paste("TEQ", standard_unit)
+
     data[id,] <- within(data[id,], {
-      ok <- unit %in% paste("TEQ", standard_unit)
+      ok <- unit %in% c(standard_unit, TEQ_unit)
       action <- ifelse(ok, "none", "error")
+
+      if (any(TEQ_unit %in% unit)) {
+        lifecycle::deprecate_warn(
+          "1.0.2", 
+          I("use of units of the form 'TEQ ug/kg' or 'TEQ pg/g'"),
+          details = c(
+            i = "use e.g. 'ug/kg' instead of 'TEQ ug/kg'", 
+            i = "you might need to update the determinand reference table"
+          ),
+          env = rlang::caller_env(), 
+          user_env = rlang::caller_env(2)
+        )
+      }  
+
     })
+  }
 
   id <- data$determinand %in% c("LNMEA")
   if (any(id))

R/import_functions.R

@@ -3444,7 +3444,7 @@ assign("determinand.link.LIPIDWT%", function(data, info, keep, drop, ...) {
 
 
 determinand.link.sum <- function(data, info, keep, drop, weights = NULL) {
-  
+
   stopifnot(length(keep) == 1, length(drop) > 1)
 
   if (!any(data$determinand %in% drop)) 
@@ -3453,10 +3453,10 @@ determinand.link.sum <- function(data, info, keep, drop, weights = NULL) {
 
   if (!is.null(weights))     {
     if (!identical(sort(drop), sort(names(weights)))) {
-    stop(
-      "error in weights list",
-      call. = FALSE
-    )
+      stop(
+        "error in weights list",
+        call. = FALSE
+      )
     }     
   }
 
@@ -3490,15 +3490,23 @@ determinand.link.sum <- function(data, info, keep, drop, weights = NULL) {
 
     # check all bases are the same 
 
-    stopifnot(dplyr::n_distinct(x$basis) == 1)
-
     if (!all(drop %in% x$determinand)) return(NULL)
+
+    if (dplyr::n_distinct(x$basis) != 1) {
+      stop(
+        "the determinands in `drop` are reported in different bases within ", 
+        "the same sample;\ncode to deal with this has not yet been written so ", 
+        "please raise an issue with the harsat\ndevelopment team",
+        call. = FALSE
+      )  
+    }
+
 
     # extract unit and weights information      
 
     id <- c("value", "uncertainty", "limit_detection", "limit_quantification")
 
-    target_unit = ctsm_get_info(info$determinand, keep, "unit", info$compartment,sep="_")
+    target_unit = ctsm_get_info(info$determinand, keep, "unit", info$compartment, sep="_")
 
     x[id] <- lapply(x[id], convert_units, from = x$unit, to = target_unit)
 
@@ -3518,7 +3526,7 @@ determinand.link.sum <- function(data, info, keep, drop, weights = NULL) {
 
     out$determinand <- keep
     out$unit <- target_unit 
-    out$group <- ctsm_get_info(info$determinand, keep, "group", info$compartment,sep="_")
+    out$group <- ctsm_get_info(info$determinand, keep, "group", info$compartment, sep="_")
     out$pargroup <- ctsm_get_info(info$determinand, keep, "pargroup")
 
     # sum value and limit_detection, make it a less-than if all are less-thans, and take 
@@ -3575,6 +3583,20 @@ determinand.link.sum <- function(data, info, keep, drop, weights = NULL) {
 
 
 determinand.link.TEQDFP <- function(data, info, keep, drop, weights) {
+
+  lifecycle::deprecate_warn(
+    "1.0.2", 
+    "determinand.link.TEQDFP()", 
+    details = c(
+      i = paste(
+        "use `determinand.link.sum()` with the TEFs supplied in the weights",
+        "argument"
+      ), 
+      i = 'see `vignette("example_HELCOM")` for further details'
+    ),
+    env = rlang::caller_env(), 
+    user_env = rlang::caller_env(2)
+  )
 
   stopifnot(length(keep) == 1, length(drop) > 1)
 
@@ -3634,7 +3656,13 @@ determinand.link.TEQDFP <- function(data, info, keep, drop, weights) {
     out <- x[which.max(x$value), ]
 
     out$determinand <- keep
-    out$unit <- "TEQ ug/kg"
+
+    target_unit <- ctsm_get_info(info$determinand, keep, "unit", info$compartment, sep="_")
+    if (grepl("TEQ", target_unit)) {
+      out$unit <- "TEQ ug/kg"
+    } else {
+      out$unit <- "ug/kg"
+    }
     out$group <- "Dioxins"
     out$pargroup <- "OC-DX"
 

R/information_functions.R

@@ -647,6 +647,26 @@ ctsm_read_determinand <- function(
   })
 
 
+  # warn about deprecated TEQ units
+
+  not_ok <- sapply(compartment, function(id) {
+    unit_id <- paste0(id, "_unit")
+    any(grepl("^TEQ ", data[[unit_id]]))
+  })
+
+  if (any(not_ok)) {
+    lifecycle::deprecate_warn(
+      "1.0.2", 
+      I("use of units such as 'TEQ ug/kg' and 'TEQ pg/g'"),
+      details = c(
+        i = "use e.g. 'ug/kg' instead of 'TEQ ug/kg'", 
+        i = "you might need to update the determinand reference table"
+      ),
+      env = rlang::caller_env(2), 
+      user_env = rlang::caller_env(3)
+    )
+  }  
+
 
   # tidy up for output
 
@@ -1976,6 +1996,20 @@ convert_units_workup <- function(units) {
 
   # could add in more units but those below cover all the ones needed to date
 
+  if (any(c("TEQ ug/kg", "TEQ pg/g") %in% units)) {
+    lifecycle::deprecate_warn(
+      "1.0.2", 
+      I("conversion between units 'TEQ ug/kg' and 'TEQ pg/g'"),
+      details = c(
+        i = "use e.g. 'ug/kg' instead of 'TEQ ug/kg'", 
+        i = "you might need to update the determinand reference table"
+      ),
+      env = rlang::caller_env(3), 
+      user_env = rlang::caller_env(4)
+    )
+  }  
+
+
   unit_group <- list(
     "length" = c("km", "m", "cm", "mm"), 
     "weight" = c("kg", "g", "mg"), 
@@ -2577,38 +2611,101 @@ get.info.imposex <- function(
 
 # TEF values ----
 
-#' TEF values for selected groups of compounds
+#' TEFs for selected groups of compounds
+#' 
+#' A list of named vectors which provide Toxic Equivalency Factors (TEFs) for
+#' calculating Toxic EQuivalent (TEQ) sums.   
 #' 
-#' A list of named vectors which currently provide the TEFs for the WHO TEQ for 
-#' dioxins, furans and dioxin-like (planar) polychlorinated biphenyls.
-#' DFP_environmental and DFP_human_health provide the TEFs appropriate for 
-#' testing against the environmental and human health standards respectively.
+#' @usage 
 #' 
-#' Adding further TEFs will require more development to the relevant 
-#' determinand_link function 
+#' info_TEF$DFP_2005
+#' info_TEF$DFP_2022
+#' 
+#' @format 
+#' 
+#' A list of named vectors:  
+#' 
+#' * `DFP_2005` gives the 2005 World Health Organisation TEFs for dioxins, 
+#' furans and dioxin-like (planar) polychlorinated biphenyls 
+#' ([Van den Berg et al. 2006](https://doi.org/10.1093/toxsci/kfl055))  
+#' * `DFP_2022` gives the 2022 World Health Organisation TEFs for dioxins, 
+#' furans and dioxin-like (planar) polychlorinated biphenyls 
+#' ([DeVito et al. 2024](https://doi.org/10.1016/j.yrtph.2023.105525))  
+#' * `DFP_HOLAS3` is a superseded version of `DFP_2005` that was used in the 
+#' HELCOM HOLAS3 assessment. It excludes CB114, CB123 and CB189 and uses code 
+#' CDFO instead of OCDF. It is included for reproducibility, but might be 
+#' removed in the future. 
+#' * `DFP_CEMP` is a superseded version of `DFP_2005` that was used in the 
+#' OSPAR CEMP assessments up to and including 2024. It excludes CB114, CB123 and 
+#' CB189, uses code CDFO instead of OCDF, and has a TEF for CDFO of 0.00003 
+#' rather than 0.0003. It is included for reproducibility, but might be removed 
+#' in the future.
+#'
+#' @references
+#' 
+#' DeVito M, Bokkers B, van Duursen MBM, van Ede K, Feeley M, Gáspár EAF, 
+#' Haws L, Kennedy S, Peterson RE, Hoogenboom R, Nohara K, Petersen K, Rider C, 
+#' Rose M, Safe S, Schrenk D, Wheeler MW, Wikoff DS, Zhao B, van den Berg M, 
+#' 2024. The 2022 world health organization reevaluation of human and mammalian 
+#' toxic equivalency factors for polychlorinated dioxins, dibenzofurans and 
+#' biphenyls. Regulatory Toxicology and Pharmacology 146; 
+#' [https://doi.org/10.1016/j.yrtph.2023.105525]
+#' 
+#' Van den Berg M, Birnbaum LS, Denison M, De Vito M, Farland W, Feeley M, 
+#' Fiedler H, Hakansson H, Hanberg A, Haws L, Rose M, Safe S, Schrenk D, 
+#' Tohyama C, Tritscher A, Tuomisto J, Tysklind M, Walker N, Peterson RE, 2006.
+#' The 2005 World Health Organization reevaluation of human and mammalian toxic 
+#' equivalency factors for dioxins and dioxin-like compounds. Toxicological 
+#' Sciences 93 223–241; [https://doi.org/10.1093/toxsci/kfl055]
 #' 
 #' @export 
 info_TEF <- list(
-  DFP_environmental = c(
+  DFP_2005 = c(    
+    "CB77" = 0.0001, "CB81" = 0.0003, "CB105" = 0.00003, "CB114" = 0.00003, 
+    "CB118" = 0.00003, "CB123" = 0.00003, "CB126" = 0.1, "CB156" = 0.00003, 
+    "CB157" = 0.00003, "CB167" = 0.00003, "CB169" = 0.03, "CB189" = 0.00003,
+    "CDD1N" = 1, "CDD4X" = 0.1, "CDD6P" = 0.01, "CDD6X" = 0.1, 
+    "CDD9X" = 0.1, "CDDO" = 0.0003, "TCDD" = 1, 
+    "CDF2N" = 0.3, "CDF2T" = 0.1, "CDF4X" = 0.1, "CDF6P" = 0.01, 
+    "CDF6X" = 0.1, "CDF9P" = 0.01, "CDF9X" = 0.1,  
+    "CDFP2" = 0.03, "CDFX1" = 0.1, "OCDF" = 0.0003
+  ),  
+  DFP_2022 = c(    
+    "CB77" = 0.0003, "CB81" = 0.006, "CB105" = 0.00003, "CB114" = 0.00003,
+    "CB118" = 0.00003, "CB123" = 0.00003, "CB126" = 0.05, "CB156" = 0.00003, 
+    "CB157" = 0.00003, "CB167" = 0.00003, "CB169" = 0.005, "CB189" = 0.00003,
+    "CDD1N" = 0.4, "CDD4X" = 0.09, "CDD6P" = 0.05, "CDD6X" = 0.07, 
+    "CDD9X" = 0.05, "CDDO" = 0.001, "TCDD" = 1,
+    "CDF2N" = 0.1, "CDF2T" = 0.07, "CDF4X" = 0.1, "CDF6P" = 0.02, 
+    "CDF6X" = 0.09, "CDF9P" = 0.1, "CDF9X" = 0.2,  
+    "CDFP2" = 0.01, "CDFX1" = 0.3, "OCDF" = 0.002
+  ),  
+  DFP_CEMP = c(
     "CB77" = 0.0001, "CB81" = 0.0003, "CB105" = 0.00003, "CB118" = 0.00003, 
     "CB126" = 0.1, "CB156" = 0.00003, "CB157" = 0.00003, "CB167" = 0.00003, 
-    "CB169" = 0.03, "CDD1N" = 1, "CDD4X" = 0.1, "CDD6P" = 0.01, "CDD6X" = 0.1, 
-    "CDD9X" = 0.1, "CDDO" = 0.0003, "CDF2N" = 0.3, "CDF2T" = 0.1, "CDF4X" = 0.1, 
-    "CDF6P" = 0.01, "CDF6X" = 0.1, "CDF9P" = 0.01,
-    "CDF9X" = 0.1, "CDFO" = 0.00003, "CDFP2" = 0.03, "CDFX1" = 0.1, "TCDD" = 1
+    "CB169" = 0.03, 
+    "CDD1N" = 1, "CDD4X" = 0.1, "CDD6P" = 0.01, "CDD6X" = 0.1, 
+    "CDD9X" = 0.1, "CDDO" = 0.0003, "TCDD" = 1, 
+    "CDF2N" = 0.3, "CDF2T" = 0.1, "CDF4X" = 0.1, "CDF6P" = 0.01, 
+    "CDF6X" = 0.1, "CDF9P" = 0.01, "CDF9X" = 0.1, "CDFO" = 0.00003, 
+    "CDFP2" = 0.03, "CDFX1" = 0.1
   ), 
-  DFP_human_health = c(
+  DFP_HOLAS3 = c(
     "CB77" = 0.0001, "CB81" = 0.0003, "CB105" = 0.00003, "CB118" = 0.00003, 
     "CB126" = 0.1, "CB156" = 0.00003, "CB157" = 0.00003, "CB167" = 0.00003, 
-    "CB169" = 0.03, "CDD1N" = 1, "CDD4X" = 0.1, "CDD6P" = 0.01, "CDD6X" = 0.1, 
-    "CDD9X" = 0.1, "CDDO" = 0.0003, "CDF2N" = 0.3, "CDF2T" = 0.1, "CDF4X" = 0.1, 
-    "CDF6P" = 0.01, "CDF6X" = 0.1, "CDF9P" = 0.01,
-    "CDF9X" = 0.1, "CDFO" = 0.0003, "CDFP2" = 0.03, "CDFX1" = 0.1, "TCDD" = 1
+    "CB169" = 0.03, 
+    "CDD1N" = 1, "CDD4X" = 0.1, "CDD6P" = 0.01, "CDD6X" = 0.1, 
+    "CDD9X" = 0.1, "CDDO" = 0.0003, "TCDD" = 1, 
+    "CDF2N" = 0.3, "CDF2T" = 0.1, "CDF4X" = 0.1, "CDF6P" = 0.01, 
+    "CDF6X" = 0.1, "CDF9P" = 0.01, "CDF9X" = 0.1, "CDFO" = 0.0003, 
+    "CDFP2" = 0.03, "CDFX1" = 0.1
   )
 )
 
 
 
+
+
 # ICES RECO codes ----
 
 # reads in data from csv files exported from ICES RECO

example_HELCOM.r

@@ -311,9 +311,9 @@ biota_timeseries <- create_timeseries(
       action = "sum"
     ),
     TEQDFP = list(
-      det = names(info_TEF$DFP_human_health), 
-      action = "bespoke", 
-      weights = info_TEF$DFP_human_health
+      det = names(info_TEF$DFP_HOLAS3),
+      action = "sum",
+      weights = info_TEF$DFP_HOLAS3
     ),
     "LIPIDWT%" = list(det = c("EXLIP%", "FATWT%"), action = "bespoke")
   ),

example_OSPAR.r

@@ -101,9 +101,9 @@ sediment_timeseries <- create_timeseries(
     CB138 = list(det = c("CB138+163"), action = "replace"),
     CB156 = list(det = c("CB156+172"), action = "replace"),
     TEQDFP = list(
-      det = names(info_TEF$DFP_environmental), 
-      action = "bespoke", 
-      weights = info_TEF$DFP_environmental
+      det = names(info_TEF$DFP_CEMP), 
+      action = "sum", 
+      weights = info_TEF$DFP_CEMP
     ),
     HCEPX = list(det = c("HCEPC", "HCEPT"), action = "sum")
   ),
@@ -214,9 +214,9 @@ biota_timeseries <- create_timeseries(
       action = "sum"
     ),
     TEQDFP = list(
-      det = names(info_TEF$DFP_environmental), 
-      action = "bespoke", 
-      weights = info_TEF$DFP_environmental
+      det = names(info_TEF$DFP_CEMP), 
+      action = "sum", 
+      weights = info_TEF$DFP_CEMP
     ),
     HCEPX = list(det = c("HCEPC", "HCEPT"), action = "sum"),
     HCH = list(det = c("HCHA", "HCHB", "HCHG"), action = "sum"),

information/AMAP/determinand.csv

@@ -552,7 +552,7 @@ TDEOP,TDE (o--p') = DDD (o--p'),OC-DD,Organochlorines,,,TRUE,FALSE,FALSE,ug/kg,,
 TDEPP,TDE (p--p'),OC-DD,Organochlorines,Organochlorines,Organochlorines,TRUE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,0.006667,0.197,0.006667,0.3,0,0.16425,lognormal,low,OSPAR,ICES
 TEBDE,tetra-bromodiphenyl ether (sum of congeners),O-BR,Organobromines,,,FALSE,FALSE,FALSE,ug/kg,,,,,,,,,,,,lognormal,low,ICES,ICES
 TEMP,temperature,P-PHY,Physical measurements,,,FALSE,FALSE,FALSE,,,,,,,,,,,,,,,ICES,ICES
-TEQDFP,WHO-TEQ (DFP),OC-DX,Dioxins,Dioxins,,TRUE,FALSE,FALSE,TEQ ug/kg,TEQ ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,0.000018,0.1375,0.000039,0.237592,,,lognormal,low,OSPAR/HELCOM,
+TEQDFP,WHO-TEQ (DFP),OC-DX,Dioxins,Dioxins,,TRUE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,0.000018,0.1375,0.000039,0.237592,,,lognormal,low,OSPAR/HELCOM,
 THCGC,total hydrocarbons (by GC),O-THC,Total hydrocarbons,,,FALSE,FALSE,FALSE,,,,,,,,,,,,,lognormal,low,ICES,ICES
 THCGR,total hydrocarbons (by gravimetry),O-THC,Total hydrocarbons,,,FALSE,FALSE,FALSE,,,,,,,,,,,,,lognormal,low,ICES,ICES
 THCIR,total hydrocarbons (by infrared spectrophotometry),O-THC,Total hydrocarbons,,,FALSE,FALSE,FALSE,,,,,,,,,,,,,lognormal,low,ICES,ICES

information/HELCOM_2023/determinand.csv

@@ -22,7 +22,9 @@ CB99,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug
 CB101,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,0.033333,0.15,0.033333,0.151854,0,0.175,lognormal,low
 CB105,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,0.00541,0.175,0.016333,0.180065,,,lognormal,low
 CB110,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
+CB114,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
 CB118,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,0.033333,0.151458,0.03,0.165,0,0.2,lognormal,low
+CB123,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
 CB126,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,3.00E-05,0.164144,,,,,lognormal,low
 CB128,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
 CB132,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
@@ -74,7 +76,8 @@ CDFDN,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYW
 CDFO,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
 CDFP2,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
 CDFX1,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
-TEQDFP,WHO-TEQ (DFP),OC-DX,Dioxins,Dioxins,,TRUE,FALSE,FALSE,TEQ ug/kg,TEQ ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,1.80E-05,0.1375,3.90E-05,0.237592,,,lognormal,low
+OCDF,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
+TEQDFP,WHO-TEQ (DFP),OC-DX,Dioxins,Dioxins,,TRUE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,1.80E-05,0.1375,3.90E-05,0.237592,,,lognormal,low
 PFOS,,O-FL,Organofluorines,Organofluorines,Organofluorines,TRUE,FALSE,TRUE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,0.066667,0.199772,,,0.003333,0.172725,lognormal,low
 N-PFOS,,O-FL,Organofluorines,Organofluorines,Organofluorines,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low
 BR-PFOS,,O-FL,Organofluorines,Organofluorines,Organofluorines,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%~LOIGN,,,,,,,,lognormal,low

information/OSPAR_2022/determinand.csv

@@ -75,7 +75,9 @@ CB99,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug
 CB101,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,TRUE,TRUE,TRUE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,0.033333,0.15,0.033333,0.151854,0,0.175,lognormal,low
 CB105,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,TRUE,TRUE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,0.00541,0.175,0.016333,0.180065,,,lognormal,low
 CB110,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
+CB114,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
 CB118,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,TRUE,TRUE,TRUE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,0.033333,0.151458,0.03,0.165,0,0.2,lognormal,low
+CB123,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
 CB126,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,TRUE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,3.00E-05,0.164144,,,,,lognormal,low
 CB128,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
 CB132,,OC-CB,Chlorobiphenyls,Chlorobiphenyls,Chlorobiphenyls,FALSE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
@@ -170,7 +172,8 @@ CDFDN,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYW
 CDFO,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
 CDFP2,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
 CDFX1,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
-TEQDFP,WHO-TEQ (DFP),OC-DX,Dioxins,Dioxins,,TRUE,TRUE,FALSE,TEQ ug/kg,TEQ ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,1.80E-05,0.1375,3.90E-05,0.237592,,,lognormal,low
+OCDF,,OC-DX,Dioxins,Dioxins,,FALSE,FALSE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,,,,,,,lognormal,low
+TEQDFP,WHO-TEQ (DFP),OC-DX,Dioxins,Dioxins,,TRUE,TRUE,FALSE,ug/kg,ug/kg,,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,1.80E-05,0.1375,3.90E-05,0.237592,,,lognormal,low
 PFOA,,O-FL,Organofluorines,Organofluorines,Organofluorines,TRUE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,0.075,0.178,,,,,lognormal,low
 PFNA,,O-FL,Organofluorines,Organofluorines,Organofluorines,TRUE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,0.05,0.25,,,,,lognormal,low
 PFDA,,O-FL,Organofluorines,Organofluorines,Organofluorines,TRUE,FALSE,FALSE,ug/kg,ug/kg,ng/l,LNMEA~LIPIDWT%~DRYWT%,AL~CORG~DRYWT%,,0.043333,0.249459,,,,,lognormal,low