From dae972e495c298a40c53bd8d610ed9a8170abeb9 Mon Sep 17 00:00:00 2001 From: Easy Build <easybuild@login4.smc.salomon.it4i.cz> Date: Fri, 9 Feb 2018 09:00:04 +0100 Subject: [PATCH] Fri, 09 Feb 2018 09:00:04 +0100 --- salomon.csv | 2 ++ salomon.md | 1 + 2 files changed, 3 insertions(+) diff --git a/salomon.csv b/salomon.csv index 9536bfd5..125c0040 100644 --- a/salomon.csv +++ b/salomon.csv @@ -1367,6 +1367,7 @@ PyCairo/1.10.0-Python-2.7.13-base,2 PyGObject/2.28.6-Python-2.7.13-base,2 PyGTK/2.24.0-Python-2.7.13-base,2 pylint/1.7.2-Python-2.7.13-base,2 +pymatgen/2018.1.29-Py-3.6,2 pyparsing/2.2.0-Py-2.7,2 pyparsing/2.2.0-Py-3.6,2 PyQt/4.11.3-foss-2015g-Python-2.7.9,2 @@ -1413,6 +1414,7 @@ pytz/2017.3-Py-3.6,2 PYXAID/1.0,2 PyYAML/3.11-intel-2015b-Python-2.7.9,2 PyYAML/3.12-Py-2.7,2 +PyYAML/3.12-Py-3.6,2 PyYAML/3.12-Python-2.7.13-base,2 pyzmq/16.0.4-Py-2.7,2 QBOX/r140b-foss-2016a,2 diff --git a/salomon.md b/salomon.md index 5667a918..53df303e 100644 --- a/salomon.md +++ b/salomon.md @@ -386,6 +386,7 @@ | [phonopy](http://python.org/) | Python is a programming language that lets you work more quickly and integrate your systems more effectively. | | [pluggy](https://github.com/pytest-dev/pluggy) | Plugin and hook calling mechanisms for python. | | [pudb](https://pypi.python.org/pypi/pudb) | PuDB is a full-screen, console-based visual debugger for Python. | +| [pymatgen](https://pypi.python.org/pypi/pymatgen) | Python Materials Genomics is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project (https://www.materialsproject.org). | | [pyparsing](http://pyparsing.wikispaces.com) | The pyparsing module provides a library of classes that client code uses to construct the grammar directly in Python code. | | [pytest](http://pytest.org) | Simple powerful testing with Python | | [python-dateutil](https://github.com/dateutil/dateutil) | Useful extensions to the standard Python datetime features. | -- GitLab