Search Results for "open-shell" - Page 17
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Showing 2179 open source projects for "open-shell"
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pyMathSpeak
A Python implementation of the MathSpeak Core Specification
pyMathSpeak is a Python package that translates MathML equations into spoken text. It implements the MathSpeak Core Specification publicly available at http://www.gh-mathspeak.com/examples/grammar-rules/ The default translation targets English. Localization for different languages is possible, and a Traditional Chinese MathML translator is included for reference. -
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Pydicom by examples
Basic and intermediate examples of DICOM library with Jupyter
Basic and intermediate examples to read, modify and write DICOM files with Python code using Jupyter - To install Jupyter - https://jupyter.org/install ====== All examples are based on Pydicom. An open source library - https://pydicom.github.io/ -
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2D Structural Analysis
Determine the bending moments, shear forces, axial forces and displace
2D Structural Analysis in Python by Ritchie Vink A collection examples of 2D Finite Element Analysis (FEA) made with Jupyter Notebook Lab - https://jupyter.org/ To install Jupyter - https://jupyter.org/install ===== App is available on Play Store -> https://play.google.com/store/apps/details?id=com.ulm.struct If you want to download a python editor for your android smartphone follow this link -> https://play.google.com/store/apps/details?id=com.ulm.python -
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Olex2 is visualisation software for small-molecule crystallography developed at Durham University/EPSRC. It provides comprehensive tools for crystallographic model manipulation for the end user and an extensible development framework for programmers. The project has been supported by Olexsys Ltd since 2010.
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RELEASE NOTE: Get raxmlGUI 2.0 at the NEW PROJECT LOCATION: https://antonellilab.github.io/raxmlGUI/ raxmlGUI is a graphical user interface to RAxML, one of the most popular and widely used software for phylogenetic inference using maximum likelihood. A userfriendly graphical front-end for phylogenetic analyses using RAxML (Stamatakis, 2006). Please cite: Silvestro, Michalak (2012) - raxmlGUI: a graphical front-end for RAxML. Organisms Diversity and Evolution 12, 335-337. DOI:...
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A symbolic framework for C++, Python and Octave implementing automatic differentiation by source code transformation in forward and reverse modes on sparse matrix-valued computational graphs.
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Software for exploring & solving polyform puzzles, written in Python. Includes solvers for: pentominoes/polyominoes, solid pentominoes, Soma cubes, polycubes, polyiamonds, polyhexes, polysticks, and more to come.
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CSV-Sanitizer
Allows the user to automatically create non-sensitive, sanitized CSVs
This project will allow the user to create non-sensitive, sanitized CSVs automatically, given any CSVs present. Its purpose? Create an easy way for people to share tasks or code that rely on sensitive CSVs, without exposing sensitive data. This project is conducted in Python3. Please see the Readme for more information :) -
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UnsupervisedMT
Phrase-Based & Neural Unsupervised Machine Translation
Unsupervised Machine Translation is a research repository that implements both phrase-based SMT and neural MT approaches for translation without parallel corpora. The neural component supports multiple architectures—seq2seq, biLSTM with attention, and Transformer—and allows extensive parameter sharing across languages to improve data efficiency. Training relies on denoising auto-encoding and back-translation, with on-the-fly, multithreaded generation of synthetic parallel data to continually... -
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Meteorological Product Exchanger
Sundew:a tcp/ip WMO switch, Sarracenia: next gen transfer engine.
We have moved to https://github.com/MetPX everything on sourceforge is obsolete. metpx is the Meteorological Product Exchanger. Intended for use in industrial/government weather forecast operations, for exchange of meteorological bulletins over TCP/IP. -
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slurm-roll
Slurm Resource Manager for Rocks Clusters
Slurm is a replacement for other resource management software and schedulers like gridengine or torque. The slurm roll integrates very well into a rocks clusters installation. In the folder addons, there are a lot of useful rolls for rocks clusters 6.1 and 6.2. These rolls do not depend on slurm. Please see Discussion for further information and support -
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PyRobot
An Open Source Robotics Research Platform
PyRobot is a high-level robotics API that simplifies controlling real and simulated robots through a consistent Python interface. Instead of fighting ROS internals, you call clear methods for things like base navigation, arm manipulation, and camera capture, and PyRobot handles the plumbing. It was built to make research repeatable on accessible platforms—most notably low-cost mobile manipulators—while still scaling to richer hardware. The library exposes canonical abstractions (base, arm,... -
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Safe Harbor Deidentification
Safe Harbor Deidentification for medical documents
Phalanx - Deidentify Safe Harbor Deidentification Mode of Phalanx is an abridged pipeline of NLP annotators culminating in NER annotators which write output of text offsets. It uses the Safe Harbor deidentification method. -
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Pikon-Stelarium interface
Pikon-Stelarium interface to use with azimuthal mount
This is a full project to make an software-drived azimuthal mount for the Pikon telescope, it can be use for others telescope. This project include : . Some other parts to print to adapt to the Pikon . Python code for raspberry Needed parts for "as it" use : . 1 Raspberry (model A suit well) . 3 motors steppers . 3 steppers drivers . 1 BNO055 (the one from adafruit was used) . 1 Pikon driver . 1 GPS module Sofware requirement : . raspbian . python 3 . some python libraries -
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ParamIT
a Toolset for Molecular Mechanical Force Field Parameterization
ParamIT is a toolkit aiding the development of molecular mechanical force field parameterization of small, drag like, molecules within CHARMM general force field (CGenFF) protocol. The developed toolkit helps the researchers in following ways: 1) automating the creation of multiple input files for quantum and molecular mechanics programs, 2) automating the output analysis and 3) substitute the use of full MM programs with a faster specialized one. The developed tools include: 1) generator of... -
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GEOMS2
Geostatistics and geosciences modeling software
GEOMS2 is a geostatistics and geosciences modeling software. Provides interface for grid (mesh), point, surface and data (non-spatial) objects. It has a 3D viewer and 2D plots using the well known Python engines Mayavi and Matplotlib. It has several functions to manipulate your data as well as provide univariate and multivariate analysis. NOTE: The software is still an early beta. Please tell us if you found a bug. Download datasets for students of Geostatistics 2017 (Petroleum... -
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Customizable weather widget
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pyfolio
Portfolio and risk analytics in Python
pyfolio is a Python library for performance and risk analysis of financial portfolios developed by Quantopian Inc. It works well with the Zipline open source backtesting library. At the core of pyfolio is a so-called tear sheet that consists of various individual plots that provide a comprehensive image of the performance of a trading algorithm. Here's an example of a simple tear sheet analyzing a strategy. Quantopian also offers a fully managed service for professionals that includes Zipline, Alphalens, Pyfolio, FactSet data, and more. -
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LaueTools
open source python packages for X-ray MicroLaue Diffraction analysis
LaueTools is an open-source project for white beam Laue x-ray microdiffraction data analysis including tools in image processing, peaks searching & indexing, crystal structure solving (orientation & strain) and data & grain mapping visualisation. Python 3 Code and new features are now at: https://gitlab.esrf.fr/micha/lauetools -
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Xplico
Xplico is a Network Forensic Analysis Tool (NFAT)
Xplico is a Network Forensic Analysis Tool (NFAT). The goal of Xplico is extract from an internet traffic capture the applications data contained. For example, from a pcap file Xplico extracts each email (POP, IMAP, and SMTP protocols), all HTTP contents, each VoIP call (SIP, MGCP, MEGACO, RTP), IRC, WhatsApp... Xplico is able to classify more than 140 (application) protocols. Xplico cam be used as sniffer-decoder if used in "live mode" or in conjunction with netsniff-ng. Xplico is used... -
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CMD Plot Tool
Calculates and plots Colour Magnitude Diagrams from Astronomical data
CMD Plot Tool calculates and plots Colour Magnitude Diagrams (CMDs) from astronomical photometric data, e.g. of a star cluster observed in two filter bandpasses. It can handle multiple file formats (plain text, DAOPHOT .mag files, ACS Survey of Galactic Globular Clusters .zpt files) to generate professional and customised plots, without the usual steep learning curve. Development using Python, OOP and a formal software development lifecycle model (Agile) allowed for the creation of an... -
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pyGear
Precise gear geometry generator for spur and helical gears
A python gear generator that serves as CAE/CAD-preprocessor for involute gears based on pythonOCC. It allows for the computation of dynamic properties and the creation of exact geometries from a minimal input set. PyGear can simulate the tool geometry and kinematics of standard gear hobbing tools to generate precise flank, tooth root and tip geometries. -
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Ljudmiljö i Stationssamhällen
Simulering av åtgärder mot buller från järnväg
En demonstrator av ett verktyg som simulerar åtgärder mot buller från järnväg. Demonstratorn är utvecklad inom projektet "God ljudmiljö i stationssamhällen - Verktygslåda och exempel till nytta för klimat, hälsa och resurseffektivitet" som bedrevs inom ramen för MISTRA Urban Futures med finansiering från programkontoret inom det strategiska innovationsprogrammet InfraSweden2030 genom Vinnova, samt från Västra Götalands regionen och Trafikverket. Projektet utfördes av RISE, Chalmers och VTI... -
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CutePy
Lightweight Qt-based Python console with variable explorer and history
CutePy is a lightweight Qt-based Python 3 console with variable explorer, command history, syntax highlighting and customizable startup script. Originally it was developed for simple scientific calculations as a replacement for e.g. Windows calculator or Python IDLE. Therefore its main aim is to start fast and provide more comfortable dealing with variables based on the Python language. However in the end it is a regular Python console and therefore can be used for almost any task. -
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Stationsnara
Simulering av åtgärder mot buller från järnväg
En demonstratar av ett verktyg som simulerar åtgärder mot buller från järnväg.
