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PR/55755 CVS commit: pkgsrc/biology



The following reply was made to PR pkg/55755; it has been noted by GNATS.

From: "Benny Siegert" <bsiegert%netbsd.org@localhost>
To: gnats-bugs%gnats.NetBSD.org@localhost
Cc: 
Subject: PR/55755 CVS commit: pkgsrc/biology
Date: Tue, 3 Nov 2020 20:17:59 +0000

 Module Name:	pkgsrc
 Committed By:	bsiegert
 Date:		Tue Nov  3 20:17:59 UTC 2020
 
 Modified Files:
 	pkgsrc/biology: Makefile
 Added Files:
 	pkgsrc/biology/coordgenlibs: DESCR Makefile PLIST buildlink3.mk
 	    distinfo
 
 Log Message:
 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.
 
 
 To generate a diff of this commit:
 cvs rdiff -u -r1.57 -r1.58 pkgsrc/biology/Makefile
 cvs rdiff -u -r0 -r1.1 pkgsrc/biology/coordgenlibs/DESCR \
     pkgsrc/biology/coordgenlibs/Makefile pkgsrc/biology/coordgenlibs/PLIST \
     pkgsrc/biology/coordgenlibs/buildlink3.mk \
     pkgsrc/biology/coordgenlibs/distinfo
 
 Please note that diffs are not public domain; they are subject to the
 copyright notices on the relevant files.
 


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