sci-chemistry/apbs/metadata.xml


1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26

<?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>
    <name>Justin Lecher</name>
    <description>Ebuild Crasher</description>
  </maintainer>
  <use>
    <flag name="fetk">Include support for FeTK</flag>
    <flag name="fast">APBS fast mode (experimental)</flag>
    <flag name="iapbs">C/C++/Fortran interface</flag>
    <flag name="tools">Install optional tools</flag>
  </use>
  <longdescription>
APBS is a software package for modeling biomolecular solvation through solution 
of the Poisson-Boltzmann equation (PBE), one of the most popular continuum 
models for describing electrostatic interactions between molecular solutes in 
salty, aqueous media. Continuum electrostatics plays an important role in 
several areas of biomolecular simulation
</longdescription>
  <upstream>
    <remote-id type="github">Electrostatics/apbs-pdb2pqr</remote-id>
  </upstream>
</pkgmetadata>