From bc00a2928f63eccd7809b71998b7862b79dc52da Mon Sep 17 00:00:00 2001 From: Egon Willighagen Date: Wed, 26 Nov 2025 07:10:09 +0100 Subject: [PATCH 1/2] Create CITATION.cff --- CITATION.cff | 30 ++++++++++++++++++++++++++++++ 1 file changed, 30 insertions(+) create mode 100644 CITATION.cff diff --git a/CITATION.cff b/CITATION.cff new file mode 100644 index 00000000..c94305dc --- /dev/null +++ b/CITATION.cff @@ -0,0 +1,30 @@ +cff-version: 1.2.0 +message: Please cite the following works when using this software. +type: software +authors: + - family-names: Lowe + given-names: Daniel M. + - family-names: Lowe + given-names: Daniel M. + - family-names: Corbett + given-names: Peter T. + - family-names: Murray-Rust + given-names: Peter + - family-names: Glen + given-names: Robert C. +doi: 10.1021/CI100384D +identifiers: + - type: doi + value: 10.1021/CI100384D + - type: other + value: urn:issn:1549-9596 + - type: other + value: pmid:21384929 +keywords: + - OPSIN + - text mining + - IUPAC nomenclature of chemistry + - open-source software + - chemical name + - IUPAC name +title: 'Chemical Name to Structure: OPSIN, an Open Source Solution' From 99585c3ce870296758f63ee9a5bc65c68312ce91 Mon Sep 17 00:00:00 2001 From: Daniel Lowe <731646+dan2097@users.noreply.github.com> Date: Sat, 20 Dec 2025 00:53:15 +0000 Subject: [PATCH 2/2] Fix duplicate author entry in CITATION.cff --- CITATION.cff | 2 -- 1 file changed, 2 deletions(-) diff --git a/CITATION.cff b/CITATION.cff index c94305dc..26630ffc 100644 --- a/CITATION.cff +++ b/CITATION.cff @@ -2,8 +2,6 @@ cff-version: 1.2.0 message: Please cite the following works when using this software. type: software authors: - - family-names: Lowe - given-names: Daniel M. - family-names: Lowe given-names: Daniel M. - family-names: Corbett