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author | Robin H. Johnson <robbat2@gentoo.org> | 2015-08-08 13:49:04 -0700 |
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committer | Robin H. Johnson <robbat2@gentoo.org> | 2015-08-08 17:38:18 -0700 |
commit | 56bd759df1d0c750a065b8c845e93d5dfa6b549d (patch) | |
tree | 3f91093cdb475e565ae857f1c5a7fd339e2d781e /sci-chemistry/pdbcat | |
download | gentoo-56bd759df1d0c750a065b8c845e93d5dfa6b549d.tar.gz gentoo-56bd759df1d0c750a065b8c845e93d5dfa6b549d.tar.bz2 gentoo-56bd759df1d0c750a065b8c845e93d5dfa6b549d.zip |
proj/gentoo: Initial commit
This commit represents a new era for Gentoo:
Storing the gentoo-x86 tree in Git, as converted from CVS.
This commit is the start of the NEW history.
Any historical data is intended to be grafted onto this point.
Creation process:
1. Take final CVS checkout snapshot
2. Remove ALL ChangeLog* files
3. Transform all Manifests to thin
4. Remove empty Manifests
5. Convert all stale $Header$/$Id$ CVS keywords to non-expanded Git $Id$
5.1. Do not touch files with -kb/-ko keyword flags.
Signed-off-by: Robin H. Johnson <robbat2@gentoo.org>
X-Thanks: Alec Warner <antarus@gentoo.org> - did the GSoC 2006 migration tests
X-Thanks: Robin H. Johnson <robbat2@gentoo.org> - infra guy, herding this project
X-Thanks: Nguyen Thai Ngoc Duy <pclouds@gentoo.org> - Former Gentoo developer, wrote Git features for the migration
X-Thanks: Brian Harring <ferringb@gentoo.org> - wrote much python to improve cvs2svn
X-Thanks: Rich Freeman <rich0@gentoo.org> - validation scripts
X-Thanks: Patrick Lauer <patrick@gentoo.org> - Gentoo dev, running new 2014 work in migration
X-Thanks: Michał Górny <mgorny@gentoo.org> - scripts, QA, nagging
X-Thanks: All of other Gentoo developers - many ideas and lots of paint on the bikeshed
Diffstat (limited to 'sci-chemistry/pdbcat')
-rw-r--r-- | sci-chemistry/pdbcat/Manifest | 1 | ||||
-rw-r--r-- | sci-chemistry/pdbcat/files/CMakeLists.txt | 11 | ||||
-rw-r--r-- | sci-chemistry/pdbcat/files/pdbcat-1.3-gcc.patch | 17 | ||||
-rw-r--r-- | sci-chemistry/pdbcat/metadata.xml | 24 | ||||
-rw-r--r-- | sci-chemistry/pdbcat/pdbcat-1.3.ebuild | 24 |
5 files changed, 77 insertions, 0 deletions
diff --git a/sci-chemistry/pdbcat/Manifest b/sci-chemistry/pdbcat/Manifest new file mode 100644 index 000000000000..80690fe7ac00 --- /dev/null +++ b/sci-chemistry/pdbcat/Manifest @@ -0,0 +1 @@ +DIST pdbcat-1.3.tar.gz 12750 SHA256 a9c554c00b34e5131ca1be61aad9332ab26eca5a905b716c47f657521368babc SHA512 369ac0c4c1d8396eaa0450feb9852d2d75ebd9862a2e403ccd42a2801e924f99c28c5d71c0b66feb4588076a8948b503823d2c75420128dd04d020253f821f4c WHIRLPOOL ba6599d06814929bf23c83bb6df7084592fcc23603a8e3116e2661df3c9d97b335c627d09249be6c862466b2d83a0100d94b366df171e1c45ec6221a22b2ca78 diff --git a/sci-chemistry/pdbcat/files/CMakeLists.txt b/sci-chemistry/pdbcat/files/CMakeLists.txt new file mode 100644 index 000000000000..7a6f348f5929 --- /dev/null +++ b/sci-chemistry/pdbcat/files/CMakeLists.txt @@ -0,0 +1,11 @@ +cmake_minimum_required (VERSION 2.6) +project (pdbcat) +add_executable(pdbcat + Common.C + Common.h + pdbcat.C + PDBData.C + PDBData.h) + +install (TARGETS pdbcat DESTINATION bin) + diff --git a/sci-chemistry/pdbcat/files/pdbcat-1.3-gcc.patch b/sci-chemistry/pdbcat/files/pdbcat-1.3-gcc.patch new file mode 100644 index 000000000000..b45c36bd8a8d --- /dev/null +++ b/sci-chemistry/pdbcat/files/pdbcat-1.3-gcc.patch @@ -0,0 +1,17 @@ + pdbcat.C | 3 ++- + 1 file changed, 2 insertions(+), 1 deletion(-) + +diff --git a/pdbcat.C b/pdbcat.C +index 0786d9b..387edf9 100644 +--- a/pdbcat.C ++++ b/pdbcat.C +@@ -17,7 +17,8 @@ + #include <stdlib.h> // for exit + #include <stdio.h> // for feof() and other file manip stuff + #include <string.h> // for strcasecmp +-#include <iostream.h> ++#include <iostream> ++using namespace std; + #include "Common.h" + #include "PDBData.h" + diff --git a/sci-chemistry/pdbcat/metadata.xml b/sci-chemistry/pdbcat/metadata.xml new file mode 100644 index 000000000000..54c920d084c3 --- /dev/null +++ b/sci-chemistry/pdbcat/metadata.xml @@ -0,0 +1,24 @@ +<?xml version="1.0" encoding="UTF-8"?> +<!DOCTYPE pkgmetadata SYSTEM "http://www.gentoo.org/dtd/metadata.dtd"> +<pkgmetadata> + <herd>sci-chemistry</herd> + <maintainer> + <email>jlec@gentoo.org</email> + </maintainer> + <longdescription> +The Brookhaven Protein Data Bank stores atomic coordinate information +for protein structures in a column based format. This is designed to +be read easily read by FORTRAN programs. Indeed, if you get the +format description (from anonymous ftp to ftp.pdb.bnl.gov, the file +/pub/format.desc.ps) they show the single input line needed to read +each record type. +However, I am a C/C++ programmer in the Unix environment. It is a +easier for me to deal with field based input than column based ones. +If the fields are white space delimited I can easily use awk and perl +to manipulate the coordinate information. So I needed some way to +convert the ATOM and HETATM records of PDB files from the standard +column based format to a field based one and back again. It needed +to denote missing fields if they exist. +That converter is `pdbcat'. +</longdescription> +</pkgmetadata> diff --git a/sci-chemistry/pdbcat/pdbcat-1.3.ebuild b/sci-chemistry/pdbcat/pdbcat-1.3.ebuild new file mode 100644 index 000000000000..f0d0b263a446 --- /dev/null +++ b/sci-chemistry/pdbcat/pdbcat-1.3.ebuild @@ -0,0 +1,24 @@ +# Copyright 1999-2013 Gentoo Foundation +# Distributed under the terms of the GNU General Public License v2 +# $Id$ + +EAPI=4 + +inherit cmake-utils + +DESCRIPTION="Manipulate and process PDB files using commonly available tools such as Perl, awk, etc" +HOMEPAGE="http://www.ks.uiuc.edu/Development/MDTools/pdbcat/" +SRC_URI="http://www.ks.uiuc.edu/Development/MDTools/${PN}/files/${P}.tar.gz" + +LICENSE="free-noncomm" +SLOT="0" +KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-linux" +IUSE="" + +PATCHES=( "${FILESDIR}"/${P}-gcc.patch ) +DOCS=( README ) + +src_prepare() { + cp "${FILESDIR}"/CMakeLists.txt . || die + cmake-utils_src_prepare +} |