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author | Ranke Johannes <johannes.ranke@agroscope.admin.ch> | 2024-06-20 15:32:48 +0200 |
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committer | Ranke Johannes <johannes.ranke@agroscope.admin.ch> | 2024-06-20 15:32:48 +0200 |
commit | 5694ab788df7d333cf1d99faac749af360ba08c4 (patch) | |
tree | 8f378f4014647bbe4ddcf5d9173bf58fd662df62 /R | |
parent | 81dd5ed73a48ba811304ab9211d501b973eb640c (diff) |
Use first 27 chars from InChIKey if BCPC returns more
Diffstat (limited to 'R')
-rw-r--r-- | R/chent.R | 4 |
1 files changed, 2 insertions, 2 deletions
@@ -699,9 +699,9 @@ pai <- R6Class("pai", attr(self$iso, "source") <- "bcpc" attr(self$iso, "status") <- self$bcpc$status bcpc_ik = self$bcpc$inchikey - if (length(bcpc_ik) == 1 && nchar(bcpc_ik) == 27 && !is.na(bcpc_ik)) { + if (length(bcpc_ik) == 1 && !is.na(bcpc_ik)) { if (is.null(self$inchikey)) { - self$inchikey = self$bcpc$inchikey + self$inchikey = substr(self$bcpc$inchikey, 1, 27) attr(self$inchikey, "source") <- "bcpc" } else { if (bcpc_ik == self$inchikey) { |