diff options
| author | bsiegert <bsiegert@pkgsrc.org> | 2020-11-03 20:17:59 +0000 |
|---|---|---|
| committer | bsiegert <bsiegert@pkgsrc.org> | 2020-11-03 20:17:59 +0000 |
| commit | 408734cba42dc484ca7835587584d71684f32380 (patch) | |
| tree | cb1a7ba93a7b5a1be01fb5902f4b2fc8462dc3c8 /biology/Makefile | |
| parent | ad8e8aab5f4be50f25e6649fc52fd40680fe0a96 (diff) | |
| download | pkgsrc-408734cba42dc484ca7835587584d71684f32380.tar.gz | |
New package, coordgenlibs-1.4.2.
Part of PR pkg/55755.
This is Schroedinger, Inc's 2D coordinate generation. It was formerly
proprietary code, but is now released under the BSD license.
The emphasis of these algorithms are on quality of 2D coordinates rather than
speed of generation. The algorithm distinguishes itself from many others by
doing well with both macrocycles and metal complexes. It also does extremely
well on typical drug-like small molecules, and has been validated on millions
of compounds.
Diffstat (limited to 'biology/Makefile')
| -rw-r--r-- | biology/Makefile | 3 |
1 files changed, 2 insertions, 1 deletions
diff --git a/biology/Makefile b/biology/Makefile index d6c8e22ef9c..a7224f2c37e 100644 --- a/biology/Makefile +++ b/biology/Makefile @@ -1,4 +1,4 @@ -# $NetBSD: Makefile,v 1.57 2020/11/03 16:41:26 bsiegert Exp $ +# $NetBSD: Makefile,v 1.58 2020/11/03 20:17:59 bsiegert Exp $ # COMMENT= Software for the biological sciences @@ -16,6 +16,7 @@ SUBDIR+= chemical-mime-data SUBDIR+= chemtool SUBDIR+= clustalw SUBDIR+= coalesce +SUBDIR+= coordgenlibs SUBDIR+= fastDNAml SUBDIR+= fastp SUBDIR+= fluctuate |