Search Results for "open-shell" - Page 28
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Showing 2293 open source projects for "open-shell"
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VirtualVEX
VEX Robotics Competition Simulator
VirtualVEX is an open-source simulator platform for the VEX robotics design system. It features full competition simulation, with automatic scoring and timing and multiple robot designs to choose from. VirtualVEX is also programmable: users can write and upload code using the bundled VVDevelop IDE, which has one-click deployment and testing support. VirtualVEX also supports dual-pad joysticks similar to those used by the actual VEX platform, allowing users to get realistic driving practice. ... -
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Discrete Dipole Aproximation Project
Plugin orientated Discrete Dipole Approximation (DDA) Solver
Discrete Dipole Approximation Project, is a software package designed to solve the Discrete Dipole Problem by the Discrete Dipole Approximation (DDA) method. This software is desgined to be plugin operated allowing for easy implimincation of new solver methods to improve the efficienty of the code. The plugin support also allow the program to write its output in multiple formats and structures defined by plugins. -
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is a molecular viewer & model builder for quantum chemistry programs. It has an interface with NWChem, CP2K and PC GAMESS/Firefly quantum programs. http://www.biomolecular-modeling.com/Products.html
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fesslix
Stochastic Analysis
A brief summary of the main features of Fesslix: - Perform non-intrusive reliability analysis or Bayesian updating either --- by running commands on the command line or --- by means of an Octave interface or --- by means of a Python interface - Flexible input language for writing Fesslix parameter files --- Control flow statements (e.g. if, for, while) --- Most parameters can be defined as functions - Working with response surfaces - Linear finite element analysis using truss, beam... -
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Event based simulator that allow to yield from nested function. Implemented using greenlet and standard thread python library.
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Osmotic Pressurization Dynamics
Calculates dynamics of osmosis-based pressure generation using PEG.
This MATLAB script calculates pressure as a function of time inside a submerged membrane-bound compartment containing an aqueous PEG solution as an osmotic driver. It can also be used to calculate a membrane's hydraulic permeability by fitting experimental data. The model used accounts for the dilution effects caused by the compartment's expansion. All of this project's resources can be found in the "Files" section. -
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Time-Evolving Block Decimation
TEBD simulates the dynamics of entangled quantum many-body systems.
Time-Evolving Block Decimation (TEBD) is a new method for efficiently simulating the dynamics of entangled quantum many-body systems. It is especially suited to one-dimensional systems governed by a Hamiltonian made of local interactions. Open Source TEBD is a package, written in Fortran 95, which allows one to simulate the entangled quantum dynamics of a one-dimensional system governed by a Hamiltonian made of local interactions using TEBD. Expectation values and correlation functions, as well as entanglement measures and entropies, can be calculated. By propagating in imaginary time, TEBD can also be used to find the ground state of a given Hamiltonian. ... -
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illustrative_progs
collection of illustrative programs:small games, simulators: C, Matlab
a collection of small and medium-sized simulation programs that I made explicitely for dydactic and/or documentation purposes. Browse the files, don't click on widnload because there are multiple zips!! All are related to rigidbody dynamics used to make vehicle simulators in the simplest way. Other types of programs may figure too: Snake or Tetris in C for showing the C programming style opted for the other, more specific programs. Possibly this is a link for supplying material to some... -
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Experiment manager
Computer science experiment manager
experimaestro is an experiment manager, and is composed of (1) a job scheduler that handles dependencies and locking (2) a modular experiment description framework, that allows easy description of the various parts of an experiments. -
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Autonomous Robot Simulator
Physically-accurate robotics simulator written in Python
ARS is a physically-accurate robotics simulator written in Python. It's main purpose is to help researchers with to develop mobile manipulators and, in general, any multi-body system. It is open-source, modular, easy to learn and use, and can be a valuable tool in the process of robot design, in the development of control and reasoning algorithms, as well as in teaching and educational activities. -
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OpenEstragon
OpenEstragon is a market economy simulator.
OpenEstragon is a market economy simulator. It contains a market module, a factory module that is based on the market, and serialization to XML facilities of the economy. Available as C++ component. -
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Census is a comprehensive cross-platform project manager and integration hub for NONMEM, the gold standard tool for model-based pharmacometric data analysis.
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Interdependent Java frameworks: AMath (abstract numbers support); AFuzzy (fuzzy numbers and methods); AMathSys (flexible solvers of linear and nonlinear algebraic and differential equations); ADSM (multi-criteria ranking and grading of alternatives).
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Top-down Modulated Pitch Model
An implementation for the Top-Down pitch model by E.Balaguer et al.
MATLAB implementation for the Top-Down Modulated Pitch model proposed by Balaguer-Ballester E., Clark, N., Coath, M., Krumholz, K. and Denham, S. L. in "Understanding Pitch Perception as a Hierarchical Process with Top-Down Modulation", published in "PLOS Computational Biology" in 2009 -
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WOLFSIM: Wideband Optical FDTD Simulator
FDTD Electomagnetic Wave Simulation Software
WOLFSIM is a Finite-Difference Time-Domain electromagnetic simulator, designed to be easy to use but still very powerful, developed and maintained by researchers at North Carolina State University. It's features include: -1D, 2D, and 3D structures that are periodic in 1 or 2 dimensions -Materials that are anisotropic in permittivity and conductivity -Obliquely incident sources -Built-in vectorial (i.e. full polarization) near-to-far-field transformation See these... -
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CADET
Chromatography Analysis and Design Toolkit
We have moved to GitHub: https://github.com/cadet The Chromatography Analysis and Design Toolkit (CADET) is developed at the Institute of Bio- and Geosciences 1 (IBG-1) under supervision of Prof. Eric von Lieres. The core of the CADET software is a fast and accurate solver for the General Rate Model (GRM) of packed bed liquid chromatography. The CADET solver covers a wide range of GRM variants, combining different transport and binding models with state-of-the-art mathematical algorithms... -
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surfit is an open source and free gridding and contouring software. surfit can do interpolation/approximation of points, contours and surfaces, can take fault lines and trend surfaces into account, can use inequalities and other conditions. Supports a lo
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Energy Complex
Solve an energy market supply/demand equilibrium problem
Find the equilibrium condition for a commodity supply, transportation and demand problem. -
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BitBang
Agent-based framework for Artificial Life and Complex Systems
BitBang is an agent-based simulation framework, best suited for complex systems or artificial life research. It is developed with ease of integration in mind, allowing the interplay with existing 3D and physics engines. -
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RTSim is a simulator for real-time systems written in C++. It has been developed as an internal project at Scuola Superiore Sant'Anna as part of many research project, mainly thanks to the work of many PhD students.
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A functional-structural model of tree growth based on carbon partitioning among individual organs that compete for resources.
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VRP2E
Two-Echelon Vehicle Routing Problem
The Two-Echelon Vehicle Routing Problem
