use_version("patch")

Meredith-Lab · Dec 15, 2023 · 6c55a98 · 6c55a98
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diff --git a/CITATION.cff b/CITATION.cff
@@ -8,7 +8,7 @@ message: 'To cite package "volcalc" in publications, please cite the package and
 type: software
 license: MIT
 title: 'volcalc: Calculate Volatility of Chemical Compounds'
-version: 2.1.0.9000
+version: 2.1.1
 doi: 10.5281/zenodo.8015155
 abstract: Use this package to calculate estimated relative volatility index values
   for organic compounds based on functional group contributions. Calculation uses

diff --git a/DESCRIPTION b/DESCRIPTION
@@ -1,6 +1,6 @@
 Package: volcalc
 Title: Calculate Volatility of Chemical Compounds
-Version: 2.1.0.9000
+Version: 2.1.1
 Authors@R: c(
     person("Kristina", "Riemer", , "[email protected]", role = c("aut", "cre", "cph"),
            comment = c(ORCID = "0000-0003-3802-3331")),

diff --git a/NEWS.md b/NEWS.md
@@ -1,4 +1,4 @@
-# volcalc (development version)
+# volcalc 2.1.1
 
 * Added Dr. Laura Meredith as a package author as the concept for volcalc originated from her.
 * Added package contributors S. Marshall Ledford (our main user and beta tester since day 1!) and Tamás Stirling (for help with SMARTS patterns)

diff --git a/inst/CITATION b/inst/CITATION
@@ -7,7 +7,7 @@ c(
                person("Eric R.", "Scott", comment = c(ORCID = "0000-0002-7430-7879")),
                person("Laura K.", "Meredith", role = "aut", comment = c(ORCID = "0000-0003-4244-4366"))),
     year = "2023",
-    note = "R package version 2.1.0",
+    note = "R package version 2.1.1",
     doi = "10.5281/zenodo.8015155",
     header = "To cite volcalc in publications please use:" 
   ),