Search Results for "chemoinformatics"
Sort By:
Showing 11 open source projects for "chemoinformatics"
View related business solutions-
Create a personalized AI chatbot for each team in minutesQueryPal is the lifeline your team needs. Our AI chatbot integrates seamlessly with your communication channels, using advanced language understanding to identify and auto-answer repetitive questions — in seconds.
-
Cloud-hosted construction project information management for improved communication, and increased efficiency.Newforma empowers over 4M professionals and 1,500 AECO firms worldwide by revolutionizing Project Information Management. We transform vast amounts of project data into a meticulously organized, easily accessible, and fully searchable resource—all from a single, centralized platform. From pre-construction to years after completion, Newforma ensures you have the critical information you need at every stage of your projects.
-
1
MolecularGraph.jl
Graph-based molecule modeling toolkit for cheminformatics
MolecularGraph.jl is a graph-based molecule modeling and chemoinformatics analysis toolkit fully implemented in Julia. -
2
MolPrep
RDkit-based Molecule Optimization Tool (CLI) in python.
...With the help of RDKit, this tool enables users to load, clean, standardize, and optimize molecular structures effortlessly. Its robust design ensures scalability and efficiency, making it ideal for chemoinformatics workflows. -
3
-
4
OPEN GENERAL SCIENTIFIC INTERFACES homepage : http://www.opengsi.org
-
Regpack: All-in-One Online Registration and Payment SoftwareRegpack is a powerful onboarding, registration, and payments platform trusted by thousands of organizations worldwide. Our mission is simple: to give you the tools to automate busywork, streamline your processes, and keep your focus where it belongs, on growing your programs and serving your clients.
-
5
The Blue Obelisk Data Repository lists many important chemoinformatics data such as element and isotope properties, atomic radii, etc. including references to original literature. Developers can use this repository to make their software interoperable.
-
6
ScreeningAssistant 2 is a modular software dedicated to perform various simple and advanced chemoinformatics analysis around chemical libraries.
-
7
PerlMol is a collection of Perl modules for chemoinformatics and computational chemistry with the philosophy that "simple things should be simple". It should be possible to write one-liners that use this toolkit to do meaningful "molecular munging".
-
8
ChemCpp is a C++ toolbox for chemoinformatics focusing on the computation of kernel functions between chemical compounds. Together with Support Vector Machines, these kernel functions find natural applications for virtual screening of molecules.
-
9
OBExtensions is a extension library for the chemoinformatics library Openbabel. It provides extensions to Openbabel, being mostly GUI widgets. OBExtensions has a 2D/3D viewer, 2D coordinates generator and some other extensions.
-
MaintainX is the world-leading mobile-first workflow management platform for industrial and frontline workers.Your day-to-day maintenance tasks, simplified. MaintainX eliminates the paperwork, so you can spend less time on your clipboard and more time getting things done.
-
10
-
11
- Previous
- You're on page 1
- Next
