summarylogtreecommitdiffstats
path: root/.SRCINFO
blob: 0e98d811d98f01d472bedd4af529d336b44be56c (plain)
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
27
28
29
30
31
32
33
34
35
36
pkgbase = pmemd
	pkgdesc = PMEMD module of AMBER software package
	pkgver = 18
	pkgrel = 3
	url = http://ambermd.org/
	arch = x86_64
	license = custom
	makedepends = make
	makedepends = gcc8
	makedepends = gcc8-fortran
	makedepends = tcsh
	makedepends = imake
	makedepends = patch
	depends = openmpi3-gcc8
	depends = fakeroot
	depends = zlib
	depends = bzip2
	depends = gcc8-libs
	depends = flex
	depends = python2
	optdepends = plumed: metadynamics support
	optdepends = plumed-mpi: metadynamics support with MPI
	options = staticlibs
	options = !buildflags
	options = !makeflags
	source = local://AmberTools19.tar.bz2
	source = local://Amber18.tar.bz2
	source = pmemd
	source = pmemd.MPI
	md5sums = afffe8a5473a0bd143b98f0396f52f0f
	md5sums = 6b38d9cfb6e33b719bdf7fe73b26e841
	md5sums = ef2dc0fec7e716075c044a019d8f8f0c
	md5sums = a4fe6129d03ad814744b85584d1aba9a

pkgname = pmemd