Jul 27 2021
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CrystFEL
a suite of programs for processing diffraction data acquired "serially" in a "snapshot" manner, such as when using the technique of Serial Femtosecond Crystallography (SFX) with a free-electron laser source.
Updated versions:
0.9.1 | Linux 64
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Jul 27 2021
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iMosflm
a data processing application for macromolecular crystallography. iMosflm (Graphical User Interface) and Mosflm (data processing application) are distributed with this package.
Updated versions:
7.3.0 | Linux 64
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Jul 23 2021
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aria2
aria2 is a lightweight multi-protocol & multi-source command-line download utility. It supports HTTP/HTTPS, FTP, SFTP, BitTorrent and Metalink. aria2 can be manipulated via built-in JSON-RPC and XML-RPC interfaces.
Updated versions:
1.35.0 | Linux 64
1.35.0 | OS X INTEL
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Jul 21 2021
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Coot
(Crystallographic Object-Oriented Toolkit) supports model building and real space refinement. This application interfaces with refmac, Phenix, and several other applications. Coot was recognized as the best structural biology application in 2008 by SBGrid.
Updated versions:
0.9.6 | Linux 64
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Jul 20 2021
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FFmpeg
a complete, cross-platform solution to record, convert and stream audio and video.
Updated versions:
4.4 | Linux 64
4.4 | OS X INTEL
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Jul 20 2021
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SAMtools
(Sequence Alignment/Map) a generic format for storing large nucleotide sequence alignments that provides various utilities for manipulating alignments, including sorting, merging, indexing and generating alignments in a per-position format.
Updated versions:
1.13 | Linux 64
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Jul 19 2021
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OpenMPI
an open source Message Passing Interface implementation that is developed and maintained by a consortium of academic, research, and industry partners. Open MPI is therefore able to combine the expertise, technologies, and resources from all across the High Performance Computing community in order to build the best MPI library available.
Updated versions:
4.1.1 | Linux 64
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Jul 19 2021
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ORCA
an electronic structure program package that is a flexible, efficient, and easy-to-use general purpose tool for quantum chemistry with specific emphasis on spectroscopic properties of open-shell molecules.
Updated versions:
5.0.0 | Linux 64
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Jul 17 2021
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Global Phasing Suite
combined installation of autoPROC, BUSTER, and SHARP available to Global Phasing consortium members.
Updated versions:
20210716 | OS X INTEL
20210716 | Linux 64
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Jul 13 2021
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gmfit
superimposes molecular subunits into the density map of their complex. To reduce computational costs for the superimposing, both subunits and complexes are transformed into GMM (Gaussian Mixture Model) using the gmconvert program. Although designed to superimpose multiple atomic models of subunits into a low-resolution 3D density map, gmfit can also be applied to superimposing two 3D density maps or two atomic models.
Updated versions:
20180516 | Linux 64
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Jul 13 2021
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intel
Redistributable Libraries for IntelĀ® C++ and Fortran 2020 Compilers.
Updated versions:
19.0.5 | Linux 64
2018.4.042 | OS X INTEL
2019.6 | Linux 64
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Jul 13 2021
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Global Phasing Suite
combined installation of autoPROC, BUSTER, and SHARP available to Global Phasing consortium members.
Updated versions:
20210420 | Linux 64
20210420 | OS X INTEL
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Jul 12 2021
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PyMOL (Schrodinger)
PyMOL from Schrodinger LLC
Updated versions:
2.4.1_198 | Linux 64
2.4.1_228 | OS X INTEL
2.5.0_268 | Linux 64
2.5.0_279 | OS X INTEL
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Jul 09 2021
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SAMtools
(Sequence Alignment/Map) a generic format for storing large nucleotide sequence alignments that provides various utilities for manipulating alignments, including sorting, merging, indexing and generating alignments in a per-position format.
Updated versions:
1.13 | OS X INTEL
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