mirror of https://github.com/msberends/AMR.git
262 lines
12 KiB
R
262 lines
12 KiB
R
# ==================================================================== #
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# TITLE #
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# AMR: An R Package for Working with Antimicrobial Resistance Data #
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# #
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# SOURCE #
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# https://github.com/msberends/AMR #
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# #
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# CITE AS #
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# Berends MS, Luz CF, Friedrich AW, Sinha BNM, Albers CJ, Glasner C #
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# (2022). AMR: An R Package for Working with Antimicrobial Resistance #
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# Data. Journal of Statistical Software, 104(3), 1-31. #
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# doi:10.18637/jss.v104.i03 #
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# #
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# Developed at the University of Groningen and the University Medical #
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# Center Groningen in The Netherlands, in collaboration with many #
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# colleagues from around the world, see our website. #
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# #
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# This R package is free software; you can freely use and distribute #
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# it for both personal and commercial purposes under the terms of the #
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# GNU General Public License version 2.0 (GNU GPL-2), as published by #
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# the Free Software Foundation. #
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# We created this package for both routine data analysis and academic #
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# research and it was publicly released in the hope that it will be #
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# useful, but it comes WITHOUT ANY WARRANTY OR LIABILITY. #
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# #
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# Visit our website for the full manual and a complete tutorial about #
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# how to conduct AMR data analysis: https://msberends.github.io/AMR/ #
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# ==================================================================== #
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# This script runs in under a minute and renews all guidelines of CLSI and EUCAST!
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# Run it with source("data-raw/reproduction_of_clinical_breakpoints.R")
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library(dplyr)
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library(readr)
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library(tidyr)
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devtools::load_all()
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# Install the WHONET 2022 software on Windows (http://www.whonet.org/software.html),
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# and copy the folder C:\WHONET\Resources to the data-raw/WHONET/ folder
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# (for ASIARS-Net update, also copy C:\WHONET\Codes to the data-raw/WHONET/ folder)
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# MICROORGANISMS WHONET CODES ----
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whonet_organisms <- read_tsv("data-raw/WHONET/Resources/Organisms.txt", na = c("", "NA", "-"), show_col_types = FALSE) %>%
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# remove old taxonomic names
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filter(TAXONOMIC_STATUS == "C") %>%
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transmute(ORGANISM_CODE = tolower(WHONET_ORG_CODE), ORGANISM) %>%
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mutate(
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# what's wrong here? all these are only in the table on subspecies level (where species == subspecies), not on species level
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ORGANISM = if_else(ORGANISM_CODE == "sau", "Staphylococcus aureus", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "pam", "Pasteurella multocida", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "kpn", "Klebsiella pneumoniae", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "caj", "Campylobacter jejuni", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "mmo", "Morganella morganii", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "sap", "Staphylococcus saprophyticus", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "fne", "Fusobacterium necrophorum", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "fnu", "Fusobacterium nucleatum", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "sdy", "Streptococcus dysgalactiae", ORGANISM),
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ORGANISM = if_else(ORGANISM_CODE == "axy", "Achromobacter xylosoxidans", ORGANISM),
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# and this one was called Issatchenkia orientalis, but it should be:
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ORGANISM = if_else(ORGANISM_CODE == "ckr", "Candida krusei", ORGANISM)
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)
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# add some general codes
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whonet_organisms <- whonet_organisms %>%
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bind_rows(data.frame(
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ORGANISM_CODE = c("ebc", "cof"),
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ORGANISM = c("Enterobacterales", "Campylobacter")
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))
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whonet_organisms.bak <- whonet_organisms
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# generate the mo codes and add their names
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whonet_organisms <- whonet_organisms.bak %>%
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mutate(mo = as.mo(gsub("(sero[a-z]*| complex| nontypable| non[-][a-zA-Z]+|var[.]| not .*|sp[.],.*|, .*variant.*|, .*toxin.*|, microaer.*| beta-haem[.])", "", ORGANISM),
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keep_synonyms = TRUE,
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language = "en"),
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mo = case_when(ORGANISM %like% "Anaerobic" & ORGANISM %like% "negative" ~ as.mo("B_ANAER-NEG"),
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ORGANISM %like% "Anaerobic" & ORGANISM %like% "positive" ~ as.mo("B_ANAER-POS"),
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ORGANISM %like% "Anaerobic" ~ as.mo("B_ANAER"),
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TRUE ~ mo),
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mo_name = mo_name(mo,
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keep_synonyms = TRUE,
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language = "en"))
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# check if coercion at least resembles the first part (genus)
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new_mo_codes <- whonet_organisms %>%
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mutate(
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first_part = sapply(ORGANISM, function(x) strsplit(gsub("[^a-zA-Z _-]+", "", x), " ")[[1]][1], USE.NAMES = FALSE),
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keep = mo_name %like_case% first_part | ORGANISM %like% "Gram " | ORGANISM == "Other" | ORGANISM %like% "anaerobic")
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# update microorganisms.codes with the latest WHONET codes
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microorganisms.codes <- microorganisms.codes %>%
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# remove all old WHONET codes, whether we (in the end) keep them or not
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filter(!toupper(code) %in% toupper(whonet_organisms$ORGANISM_CODE)) %>%
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# and add the new ones
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bind_rows(new_mo_codes %>%
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filter(keep == TRUE) %>%
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transmute(code = toupper(ORGANISM_CODE),
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mo = mo)) %>%
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arrange(code)
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# Run this part to update ASIARS-Net:
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# start
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asiarsnet <- read_tsv("data-raw/WHONET/Codes/ASIARS_Net_Organisms_ForwardLookup.txt")
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asiarsnet <- asiarsnet %>%
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mutate(WHONET_Code = toupper(WHONET_Code)) %>%
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left_join(whonet_organisms %>% mutate(WHONET_Code = toupper(ORGANISM_CODE))) %>%
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mutate(
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mo1 = as.mo(ORGANISM_CODE),
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mo2 = as.mo(ORGANISM)
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) %>%
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mutate(mo = if_else(mo2 == "UNKNOWN" | is.na(mo2), mo1, mo2)) %>%
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filter(!is.na(mo))
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insert1 <- asiarsnet %>% transmute(code = WHONET_Code, mo)
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insert2 <- asiarsnet %>% transmute(code = as.character(ASIARS_Net_Code), mo)
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# these will be updated
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bind_rows(insert1, insert2) %>%
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rename(mo_new = mo) %>%
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left_join(microorganisms.codes) %>%
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filter(mo != mo_new)
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microorganisms.codes <- microorganisms.codes %>%
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filter(!code %in% c(insert1$code, insert2$code)) %>%
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bind_rows(insert1, insert2) %>%
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arrange(code)
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# end
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# save to package
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usethis::use_data(microorganisms.codes, overwrite = TRUE, compress = "xz", version = 2)
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rm(microorganisms.codes)
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devtools::load_all()
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# BREAKPOINTS ----
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# now that we have the right MO codes, get the breakpoints and convert them
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whonet_breakpoints <- read_tsv("data-raw/WHONET/Resources/Breakpoints.txt", na = c("", "NA", "-"), show_col_types = FALSE) %>%
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filter(BREAKPOINT_TYPE == "Human", GUIDELINES %in% c("CLSI", "EUCAST"))
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whonet_antibiotics <- read_tsv("data-raw/WHONET/Resources/Antibiotics.txt", na = c("", "NA", "-"), show_col_types = FALSE) %>%
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arrange(WHONET_ABX_CODE) %>%
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distinct(WHONET_ABX_CODE, .keep_all = TRUE)
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breakpoints <- whonet_breakpoints %>%
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mutate(code = toupper(ORGANISM_CODE)) %>%
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left_join(bind_rows(microorganisms.codes,
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# GEN (Generic) and ALL (All) are PK/PD codes
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data.frame(code = c("ALL", "GEN"),
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mo = rep(as.mo("UNKNOWN"), 2))))
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# these ones lack a MO name, they cannot be used:
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unknown <- breakpoints %>%
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filter(is.na(mo)) %>%
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pull(code) %>%
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unique()
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breakpoints %>%
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filter(code %in% unknown)
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breakpoints <- breakpoints %>%
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filter(!is.na(mo))
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# and these ones have unknown antibiotics according to WHONET itself:
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breakpoints %>%
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filter(!WHONET_ABX_CODE %in% whonet_antibiotics$WHONET_ABX_CODE) %>%
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count(YEAR, GUIDELINES, WHONET_ABX_CODE) %>%
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arrange(desc(YEAR))
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# we cannot use them
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breakpoints <- breakpoints %>%
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filter(WHONET_ABX_CODE %in% whonet_antibiotics$WHONET_ABX_CODE)
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# now check with our own antibiotics
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breakpoints %>%
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filter(!toupper(WHONET_ABX_CODE) %in% antibiotics$ab) %>%
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pull(WHONET_ABX_CODE) %>%
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unique()
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# they are at the moment all old codes that have right replacements in `antibiotics`, so we can use as.ab()
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breakpoints_new <- breakpoints %>%
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# only last available 10 years
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filter(YEAR > max(YEAR) - 10) %>%
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transmute(
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guideline = paste(GUIDELINES, YEAR),
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method = TEST_METHOD,
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site = gsub(".*(UTI|urinary|urine).*", "UTI", SITE_OF_INFECTION, ignore.case = TRUE),
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mo,
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rank_index = case_when(
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is.na(mo_rank(mo)) ~ 6, # for UNKNOWN, B_GRAMN, B_ANAER, B_ANAER-NEG, etc.
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mo_rank(mo) %like% "(infra|sub)" ~ 1,
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mo_rank(mo) == "species" ~ 2,
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mo_rank(mo) == "genus" ~ 3,
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mo_rank(mo) == "family" ~ 4,
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mo_rank(mo) == "order" ~ 5,
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TRUE ~ 6
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),
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ab = as.ab(WHONET_ABX_CODE),
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ref_tbl = REFERENCE_TABLE,
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disk_dose = POTENCY,
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breakpoint_S = S,
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breakpoint_R = R,
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uti = ifelse(is.na(site), FALSE, site == "UTI")
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) %>%
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# Greek symbols and EM dash symbols are not allowed by CRAN, so replace them with ASCII:
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mutate(disk_dose = disk_dose %>%
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gsub("μ", "u", ., fixed = TRUE) %>% # this is 'mu', \u03bc
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gsub("µ", "u", ., fixed = TRUE) %>% # this is 'micro', u00b5 (yes, they look the same)
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gsub("–", "-", ., fixed = TRUE)) %>%
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arrange(desc(guideline), ab, mo, method) %>%
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filter(!(is.na(breakpoint_S) & is.na(breakpoint_R)) & !is.na(mo) & !is.na(ab)) %>%
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distinct(guideline, ab, mo, method, site, breakpoint_S, .keep_all = TRUE)
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# check the strange duplicates
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breakpoints_new %>%
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mutate(id = paste(guideline, ab, mo, method, site)) %>%
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filter(id %in% .$id[which(duplicated(id))])
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# clean disk zones and MICs
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breakpoints_new[which(breakpoints_new$method == "DISK"), "breakpoint_S"] <- as.double(as.disk(breakpoints_new[which(breakpoints_new$method == "DISK"), "breakpoint_S", drop = TRUE]))
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breakpoints_new[which(breakpoints_new$method == "DISK"), "breakpoint_R"] <- as.double(as.disk(breakpoints_new[which(breakpoints_new$method == "DISK"), "breakpoint_R", drop = TRUE]))
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# WHONET has no >1024 but instead uses 1025, 513, etc, so as.mic() cannot be used to clean.
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# instead, clean based on MIC factor levels
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m <- unique(as.double(as.mic(levels(as.mic(1)))))
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breakpoints_new[which(breakpoints_new$method == "MIC" &
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is.na(breakpoints_new$breakpoint_S)), "breakpoint_S"] <- min(m)
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breakpoints_new[which(breakpoints_new$method == "MIC" &
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is.na(breakpoints_new$breakpoint_R)), "breakpoint_R"] <- max(m)
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# raise these one higher valid MIC factor level:
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breakpoints_new[which(breakpoints_new$breakpoint_R == 129), "breakpoint_R"] <- m[which(m == 128) + 1]
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breakpoints_new[which(breakpoints_new$breakpoint_R == 257), "breakpoint_R"] <- m[which(m == 256) + 1]
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breakpoints_new[which(breakpoints_new$breakpoint_R == 513), "breakpoint_R"] <- m[which(m == 512) + 1]
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breakpoints_new[which(breakpoints_new$breakpoint_R == 1025), "breakpoint_R"] <- m[which(m == 1024) + 1]
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# WHONET adds one log2 level to the R breakpoint for their software, e.g. in AMC in Enterobacterales:
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# EUCAST 2022 guideline: S <= 8 and R > 8
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# WHONET file: S <= 8 and R >= 16
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breakpoints_new %>% filter(guideline == "EUCAST 2022", ab == "AMC", mo == "B_[ORD]_ENTRBCTR", method == "MIC")
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# this will make an MIC of 12 I, which should be R, so:
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breakpoints_new <- breakpoints_new %>%
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mutate(breakpoint_R = ifelse(guideline %like% "EUCAST" & method == "MIC" & log2(breakpoint_R) - log2(breakpoint_S) != 0,
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pmax(breakpoint_S, breakpoint_R / 2),
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breakpoint_R
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))
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# fix disks as well
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breakpoints_new <- breakpoints_new %>%
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mutate(breakpoint_R = ifelse(guideline %like% "EUCAST" & method == "DISK" & breakpoint_S - breakpoint_R != 0,
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breakpoint_R + 1,
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breakpoint_R
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))
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# fix missing R breakpoint where there is an S breakpoint
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breakpoints_new[which(is.na(breakpoints_new$breakpoint_R)), "breakpoint_R"] <- breakpoints_new[which(is.na(breakpoints_new$breakpoint_R)), "breakpoint_S"]
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# check again
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breakpoints_new %>% filter(guideline == "EUCAST 2022", ab == "AMC", mo == "B_[ORD]_ENTRBCTR", method == "MIC")
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# compare with current version
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clinical_breakpoints %>% filter(guideline == "EUCAST 2022", ab == "AMC", mo == "B_[ORD]_ENTRBCTR", method == "MIC")
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# check dimensions
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dim(breakpoints_new)
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dim(clinical_breakpoints)
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# Save to package ----
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clinical_breakpoints <- breakpoints_new
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usethis::use_data(clinical_breakpoints, overwrite = TRUE, compress = "xz", version = 2)
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rm(clinical_breakpoints)
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devtools::load_all(".")
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