From ee75a2948d335465d2f605e16f3e00f4761294a5 Mon Sep 17 00:00:00 2001 From: Andrius Merkys Date: Wed, 13 May 2020 07:28:39 +0300 Subject: [PATCH 1/2] Fixing SMILES for perhydroisoquinoline. --- opensmiles.asciidoc | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/opensmiles.asciidoc b/opensmiles.asciidoc index 627cb45..46ac965 100644 --- a/opensmiles.asciidoc +++ b/opensmiles.asciidoc @@ -453,9 +453,9 @@ forms a cyclic structure. [options="header",frame="topbot",grid="rows",width="90%"] |================================================================================== -| Depiction | SMILES | Name -| image:depict/cyclohexane.gif[] | `C1CCCCC1` | cyclohexane -| image:depict/perhydroisoquinoline.gif[] | `N1CC2CCCC2CC1` | perhydroisoquinoline +| Depiction | SMILES | Name +| image:depict/cyclohexane.gif[] | `C1CCCCC1` | cyclohexane +| image:depict/perhydroisoquinoline.gif[] | `N1CC2CCCCC2CC1` | perhydroisoquinoline |================================================================================== If a bond symbol is present between the atom and rnum, it can be From 2ebc273caf8d1f13a452c7e5cba1d3e00eee5506 Mon Sep 17 00:00:00 2001 From: Andrius Merkys Date: Wed, 13 May 2020 07:30:37 +0300 Subject: [PATCH 2/2] Extending table borders. --- opensmiles.asciidoc | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/opensmiles.asciidoc b/opensmiles.asciidoc index 46ac965..da7d3a4 100644 --- a/opensmiles.asciidoc +++ b/opensmiles.asciidoc @@ -452,11 +452,11 @@ later in the string, a bond is made between the two atoms, which typically forms a cyclic structure. [options="header",frame="topbot",grid="rows",width="90%"] -|================================================================================== +|=================================================================================== | Depiction | SMILES | Name | image:depict/cyclohexane.gif[] | `C1CCCCC1` | cyclohexane | image:depict/perhydroisoquinoline.gif[] | `N1CC2CCCCC2CC1` | perhydroisoquinoline -|================================================================================== +|=================================================================================== If a bond symbol is present between the atom and rnum, it can be present on *either or both* bonded atoms. However, if it appears on