git: d9cc41090e3c - main - science/tinker: update 8.11.1 → 8.11.2

From: Yuri Victorovich <yuri_at_FreeBSD.org>
Date: Mon, 06 May 2024 08:23:32 UTC
The branch main has been updated by yuri:

URL: https://cgit.FreeBSD.org/ports/commit/?id=d9cc41090e3c2fcbac67b2b37679f167257fbafa

commit d9cc41090e3c2fcbac67b2b37679f167257fbafa
Author:     Yuri Victorovich <yuri@FreeBSD.org>
AuthorDate: 2024-05-06 08:18:53 +0000
Commit:     Yuri Victorovich <yuri@FreeBSD.org>
CommitDate: 2024-05-06 08:23:25 +0000

    science/tinker: update 8.11.1 → 8.11.2
---
 science/tinker/Makefile                  |  2 +-
 science/tinker/distinfo                  |  6 +++---
 science/tinker/files/patch-make_Makefile | 10 +++++-----
 science/tinker/pkg-plist                 |  5 ++++-
 4 files changed, 13 insertions(+), 10 deletions(-)

diff --git a/science/tinker/Makefile b/science/tinker/Makefile
index 6de3707bb4d7..209d96af7e6a 100644
--- a/science/tinker/Makefile
+++ b/science/tinker/Makefile
@@ -1,5 +1,5 @@
 PORTNAME=	tinker
-DISTVERSION=	8.11.1
+DISTVERSION=	8.11.2
 CATEGORIES=	science
 MASTER_SITES=	https://dasher.wustl.edu/tinker/downloads/
 
diff --git a/science/tinker/distinfo b/science/tinker/distinfo
index 7f0aa845abc3..e044bef304ac 100644
--- a/science/tinker/distinfo
+++ b/science/tinker/distinfo
@@ -1,3 +1,3 @@
-TIMESTAMP = 1713071651
-SHA256 (tinker-8.11.1.tar.gz) = cdbf2dfb5e43c3438b27ac8b767c9290ae2948e62333149babd72a6811963731
-SIZE (tinker-8.11.1.tar.gz) = 74273877
+TIMESTAMP = 1714980546
+SHA256 (tinker-8.11.2.tar.gz) = 26e9a634eec62c6ce951c0c60464087cf2fae905573c7047db462777397209b3
+SIZE (tinker-8.11.2.tar.gz) = 72151636
diff --git a/science/tinker/files/patch-make_Makefile b/science/tinker/files/patch-make_Makefile
index e1f412c1b22f..4b7b308532ab 100644
--- a/science/tinker/files/patch-make_Makefile
+++ b/science/tinker/files/patch-make_Makefile
@@ -1,14 +1,14 @@
---- make/Makefile.orig	2024-04-08 01:19:41 UTC
+--- make/Makefile.orig	2024-05-04 16:08:28 UTC
 +++ make/Makefile
-@@ -86,7 +86,7 @@ F77FLAGS = -c
+@@ -68,7 +68,7 @@ F77FLAGS = -c
  
  F77 = gfortran
  F77FLAGS = -c
 -OPTFLAGS = -Ofast -march=native -fopenmp
 +OPTFLAGS = -Ofast $(PORT_SIMD_FLAGS) -fopenmp
- #OPTFLAGS = -Ofast -fopenmp
- #OPTFLAGS = -Og -g -fbacktrace -fcheck=bounds -Wunused -Wmaybe-uninitialized
- LIBDIR = -L. -L$(TINKER_LIBDIR)/macos
+ OPTFLAGS = -Ofast -fopenmp
+ OPTFLAGS = -Og -g -fbacktrace -fcheck=bounds -Wunused -Wmaybe-uninitialized
+ LIBDIR = -L. -L$(TINKER_LIBDIR)/linux -Wl,--no-as-needed -ldl
 @@ -829,138 +829,138 @@ rename_bin:
  	cat *.f *.c > tinker.txt
  
diff --git a/science/tinker/pkg-plist b/science/tinker/pkg-plist
index 04f2dc7f3175..a04403c2275f 100644
--- a/science/tinker/pkg-plist
+++ b/science/tinker/pkg-plist
@@ -64,6 +64,7 @@ bin/xyzint
 bin/xyzmol2
 bin/xyzpdb
 %%DATADIR%%/params/0README
+%%DATADIR%%/params/amber14sb.prm
 %%DATADIR%%/params/amber94.prm
 %%DATADIR%%/params/amber96.prm
 %%DATADIR%%/params/amber98.prm
@@ -71,8 +72,8 @@ bin/xyzpdb
 %%DATADIR%%/params/amber99sb.prm
 %%DATADIR%%/params/amoeba04.prm
 %%DATADIR%%/params/amoeba09.prm
+%%DATADIR%%/params/amoebabio-hfc23.prm
 %%DATADIR%%/params/amoebabio09.prm
-%%DATADIR%%/params/amoebabio18-hfc23.prm
 %%DATADIR%%/params/amoebabio18.prm
 %%DATADIR%%/params/amoebail22.prm
 %%DATADIR%%/params/amoebanuc17.prm
@@ -84,6 +85,7 @@ bin/xyzpdb
 %%DATADIR%%/params/charmm22.prm
 %%DATADIR%%/params/charmm22cmap.prm
 %%DATADIR%%/params/dang.prm
+%%DATADIR%%/params/hippo19.prm
 %%DATADIR%%/params/hoch.prm
 %%DATADIR%%/params/iwater.prm
 %%DATADIR%%/params/mm2.prm
@@ -92,6 +94,7 @@ bin/xyzpdb
 %%DATADIR%%/params/mmff.prm
 %%DATADIR%%/params/oplsaa.prm
 %%DATADIR%%/params/oplsaal.prm
+%%DATADIR%%/params/oplsaam.prm
 %%DATADIR%%/params/oplsua.prm
 %%DATADIR%%/params/smoothaa.prm
 %%DATADIR%%/params/smoothua.prm