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MX_Pmodule/EM/relion/modulefile
Spencer Bliven b5a0300933 Add relion build script.
Builds from source based on git.

Currently only gcc/7.4.0 is used. Better performance is reported with
intel icc and MKL, but this would require additional openmpi variants.

Variants for 3.0.8 and 3.1-beta (780dd7b) are installed.
2019-10-24 16:03:36 +02:00

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#%Module1.0
module-whatis "3D reconstructions or 2D class averages in electron cryo-microscopy (cryo-EM)"
module-url "https://www2.mrc-lmb.cam.ac.uk/relion/index.php/Main_Page"
module-license "GPLv2 license"
module-maintainer "Spencer Bliven <spencer.bliven@psi.ch>"
module-help "
RELION (for REgularised LIkelihood OptimisatioN, pronounce rely-on) is a
stand-alone computer program that employs an empirical Bayesian approach to
refinement of (multiple) 3D reconstructions or 2D class averages in electron
cryo-microscopy (cryo-EM). It is developed in the group of Sjors Scheres at the
MRC Laboratory of Molecular Biology. Briefly, the ill-posed problem of
3D-reconstruction is regularised by incorporating prior knowledge: the fact
that macromolecular structures are smooth, i.e. they have limited power in the
Fourier domain. In the corresponding Bayesian framework, many parameters of a
statistical model are learned from the data, which leads to objective and
high-quality results without the need for user expertise. The underlying theory
is given in Scheres (2012) JMB. A more detailed description of its
implementation is given in Scheres (2012) JSB. If RELION is useful in your
work, please cite at least one of these papers.
Scheres(2012) JMB http://www.sciencedirect.com/science/article/pii/S0022283611012290
Scheres(2012) JSB http://www.sciencedirect.com/science/article/pii/S1047847712002481
"