Search Results for "chemical drawing software"
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Showing 32 open source projects for "chemical drawing software"
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fpdf2
Simple PDF generation for Python
fpdf2 is a library for simple & fast PDF document generation in Python. It is a fork and the successor of PyFPDF. Compared with other PDF libraries, fpdf2 is fast, versatile, easy to learn and to extend (example). It is also entirely written in Python and has very few dependencies: Pillow, defusedxml, & fontTools. It is a fork and the successor of PyFPDF. -
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Awesome Free ChatGPT
List of free ChatGPT mirror sites, continuously updated
This is a curated directory of freely accessible ChatGPT-style services and mirror sites that offer AI chatbot interfaces without login or payment requirements. Resources often support multiple models like GPT-4, Claude, Gemini, and more. Data collected from multiple independent sites with descriptions and tags. Includes services with image upload and drawing capabilities. Aggregates free, no-login-required ChatGPT-like web services. Continually updated mirror list to maintain availability. -
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ChemCanvas
Chemical structure drawing tool
This is targeted to be the most intuitive opensource 2D chemical drawing tool. You can draw organic chemical structures and reactions very easily and quickly. Available to download for Windows and Linux (AppImage, Flatpak, Snap) -
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Chemical Trajectory Analyzer
A software package for processing and analyzing chemical trajectories
ChemTraYzer creates reaction models from molecular dynamics simulations. It's available as open software (MIT license). Please find a full description @ https://www.ltt.rwth-aachen.de/cms/LTT/Forschung/Forschung-am-LTT/Model-Based-Fuel-Design/Aktuelle-Projekte/~kqbf/ChemTraYzer/lidx/1 M.Döntgen, M.-D.Przybylski-Freund, L.C.Kröger, W.A.Kopp, A.E.Ismail, K.Leonhard, "Automated Discovery of Reaction Pathways, Rate Constants, and Transition States Using Reactive Molecular Dynamics Simulations", J. ... -
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Pixelorama
A free & open-source 2D sprite editor, made with the Godot Engine
Pixelorama is a free and open-source pixel art editor, proudly created with the Godot Engine, by Orama Interactive. Whether you want to make animated pixel art, game graphics, tiles and any kind of pixel art you want, Pixelorama has you covered with its variety of tools and features. Free to use for everyone, forever. A variety of different tools to help you draw, with the ability to map a different tool in each left and right mouse buttons. Are you an animator? Pixelorama has its own... -
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pyTermTk
Python Terminal Toolkit - a Spiced Up TUI Library
pyTermTk is a Text-based user interface library (TUI). Evolved from the discontinued project pyCuT and inspired by a mix of Qt5, GTK, and tkinter API definition with a touch of personal interpretation. -
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The Arcade Library
Easy to use Python library for creating 2D arcade games
Arcade is an easy-to-use Python library for creating 2D video games. It provides a modern and straightforward API, enabling developers to craft engaging games and graphical applications efficiently. Arcade supports rendering shapes, handling user input, and managing game physics, making it suitable for both beginners and experienced developers. -
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DWSIM - Open Source Process Simulator
Simulate chemical processes using advanced thermodynamic models
DWSIM is an open source, CAPE-OPEN compliant chemical process simulator for Windows, Linux and macOS systems. Written in VB.NET and C#, DWSIM features a comprehensive set of unit operations, advanced thermodynamic models, support for reacting systems, petroleum characterization tools and a fully-featured graphical interface. DWSIM Pro is a commercial sibling of DWSIM built on top of open-source software. -
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PyRx - Virtual Screening Tool
Virtual Screening software for Computational Drug Discovery
...PyRx also includes chemical spreadsheet-like functionality and powerful visualization engine that are essential for Rational Drug Design. Please visits PyRx home page to learn more about PyRx and watch videos on how to use it. -
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PoseidonQ - AI/ML Based QSAR Modeling
ML based QSAR Modelling And Translation of Model to Deployable WebApps
- This Software was made with an intention to make QSAR/QSPR development more efficient and reproducible. - Published in ACS, Journal of Chemical Information and Modeling . Link : https://pubs.acs.org/doi/10.1021/acs.jcim.4c02372 - Simple to use and no compromise on essential features necessary to make reliable QSAR models. - From Generating Reliable ML Based QSAR Models to Developing Your Own QSAR WebApp. -
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OpenFieldAI - AI Open Field Test Tracker
OpenFieldAI is an AI based Open Field Test Rodent Tracker
OpenFieldAI use AI-CNN to track rodents movement with pretrained OFAI models , or user could create their own model with YOLOv8 for inferencing. The software generates Centroid graph, Heat map and Line path and a spreadsheet containing all calculated parameters like - Speed - Time in and out of ROI - Distance - Entries/Exits for single/multiple pre-recorded videos or live webcam video. The ROI is assigned automatically in multiple video input , and can be manually given in single... -
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Arianne RPG
Arianne is an engine to develop multiplayer online games like Stendhal
Arianne is a multiplayer online engine to develop turn based and real time games, providing a simple way of creating the game server rules and clients like our MORPG Stendhal. Our engine Marauroa uses Java and SQL for hosting hundreds of players on a solo host. Stendhal is a fun friendly and free multiplayer online adventure game with a huge and rich world. With hundreds of NPCs and different quests, features like the Travel log and achievement system keep track of progress. Thousands of... -
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MzDOCK - Multiple Ligand Docking Tool
MzDOCK is A Virtual Screening Tool For Drug Discovery Research
...Link: https://onlinelibrary.wiley.com/doi/abs/10.1002/jcc.27390 - Developed with Synchronized functioning of Python and Batch scripts -Integerated With Pymol-open-source for visualizing interaction (PSE file) generated from MzDOCK - Integrated with Molecule Drawing Tool - JSME Editor - If you are facing any issues or for queries . Contact us - kabeermuzammil614@gmail.com MzDOCK Development - Available on WindowsOS and Linux ubuntu 22.04 and more - Software Authorship - Muzammil Kabier -
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GromacsProSuite
Graphical User Interface for Gromacs
This tool is an integrated graphical interface that simplifies molecular dynamics simulations using Gromacs. It provides a structured, tab-based environment to set up, execute, and analyze simulations data without complex command-line operations. The software automates tasks such as topology generation, solvation, ion addition, minimization, equilibration, and production runs while executing GROMACS commands in the background. Built-in monitoring tracks CPU, RAM, and disk usage to ensure... -
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LibreOffice
A free and powerful office suite
LibreOffice is a free and powerful office suite, and a successor to OpenOffice. Its clean interface and feature-rich tools help you unleash your creativity and enhance your productivity. LibreOffice is Free and Open Source Software (FOSS) – development is open to new talent and new ideas, and our software is tested and used daily by a large and devoted user community. Your documents will look professional and clean, regardless of their purpose: a letter, a master thesis, a brochure,... -
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CEA Simplified
tkinter wrapper for NASA CEA focused in rocket chemistry explanations
CEA Simplified is a GUI for a released version of NASA's CEA program from the 1970s. It is similar to the rocketCEA library for python or the ProPEP GUIs in that it attempts to provide an updated tool for using the same underlying software, but it is more focused on being beginner friendly. -
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Cantera is a suite of object-oriented software tools for problems involving chemical kinetics, thermodynamics, and/or transport processes. It can be used from MATLAB, Python, C++, or Fortran.
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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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Face Recognition
World's simplest facial recognition api for Python & the command line
Face Recognition is the world's simplest face recognition library. It allows you to recognize and manipulate faces from Python or from the command line using dlib's (a C++ toolkit containing machine learning algorithms and tools) state-of-the-art face recognition built with deep learning. Face Recognition is highly accurate and is able to do a number of things. It can find faces in pictures, manipulate facial features in pictures, identify faces in pictures, and do face recognition on a... -
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GCompris : I got IT
Educational Software for children aged 2 to 10.
GCompris is a high quality educational software suite comprising of numerous activities for children aged 2 to 10. Some of the activities are game oriented, but nonetheless still educational. -
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cpR Chemical Pathology interface for R
A graphical user interface to R for use in Clinical Chemistry
This project is a graphical user interface to the R statistical programming language designed for use in Clinical Chemistry. It allows the user to perform Passing Bablok, Deming and Linear Regression and to produce high quality images in any file format for publication. The front end is written in Python 3.3 and PyQt4 and the form was designed using Qt4 Designer. The statistical analysis is written in R. The compiled binary was made with cx_freeze. This software is free and... -
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pychemqt
Chemical Engineering process simulations program
pychemqt is a software for simulate units operations in Chemical Engineering -
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Dia Diagram Editor
Free drawing software for Windows, Mac OS X, and Linux
Dia Diagram Editor is free Open Source drawing software for Windows, Mac OS X and Linux. Dia supports more than 30 different diagram types like flowcharts, network diagrams, database models. More than a thousand readymade objects help to draw professional diagrams. Dia can read and write a number of different raster and vector image formats. Software developers and database specialists can use Dia as a CASE tool to generate code skeletons from their drawings. ... -
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WebChemViewer
A simple program for sharing molecular structures with associated data
Sharing lists of molecular structures with associated chemical properties is a common task in computer-aided drug design and medicinal chemistry. WebChem Viewer is a simple, free, open-source program that generates HTML-formatted output that can be viewed in any modern web browser, on any operating system (including mobile), without requiring the installation of additional software. The output can also be easily incorporated into existing web pages. -
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ParaSim
Parallelized calculation of molecular similarities
...As as special feature, ParaSim allows to store and and to access frequently queried datasets as persistant objects in memory for short response times. ParaSim calculates chemical similarities based on binary structural fingerprints. It does not compute fingerprints by itself but relies on third party software to do so. Basically, all types of structural fingerprints which can be stored in an array of bits (a bitset) can be used by ParaSim. See the Wiki (https://sourceforge.net/p/parasim/wiki/Documentation/) for detailed documentation. ...
