Molinspiration Cheminformatics
Science - Chemistry - Software - Cheminformatics. Web-enabled software for large-scale calculation of molecular properties and database searches. Free online molecular descriptor calculations. ...
www.molinspiration.com
The Cheminformatics and QSAR Society
Science - Chemistry - Computational - Associations. Organization for people involved in cheminformatics, or investigating quantitative structure-activity relationships in medicinal, agricultural or environmental chemistry. ...
www.qsar.org
Institute of Cheminformatics Studies
Regional - Asia - India - Uttar Pradesh - Localities - Noida - Education. Offers courses in chemical informatics, drug design, chemical engineering, and related sciences. ...
www.cheminformaticscentre.org
Medit
Science - Chemistry - Software - Companies. Providers of software solutions for molecular modelling and cheminformatics, using structural experimental data as the guideline for drug design. ...
www.medit-pharma.com
DMax Chemistry Assistant
Science - Chemistry - Software - Cheminformatics. Software for small molecule screening data analysis and QSAR hypothesis generation. The models can be used for compound property prediction or as guidelines for lead optimization. ...
www.pharmadm.com
Cheminformatics.org
Science - Chemistry - Software - Cheminformatics. Links to cheminformatics programs and QSAR datasets. Most programs are free, at least to academics. ...
www.cheminformatics.org
Molecular Conceptor Learning Series
Science - Chemistry - Software - Educational. Interactive, computer-based learning suite that teaches the principles and techniques used in drug discovery. Modules include medicinal chemistry, drug de ...
www.drugdesign.com
SciTegic, Inc
Science - Chemistry - Analytical - Software. Offers drug discovery informatics software and services for data mining and analysis in cheminformatics and bioinformatics. ...
www.scitegic.com
Ilib diverse
Science - Chemistry - Software - Cheminformatics. Organic compound library generation program using Monte Carlo randomization and property filtering. ...
www.inteligand.com
MayaChemTools
Science - Chemistry - Software - Cheminformatics. Free collection of Perl scripts to support day-to-day computational discovery needs. ...
www.mayachemtools.org
LigandScout
Science - Chemistry - Software - Cheminformatics. A software tool for PDB interpretation, 3D pharmacophore creation, modeling and visualization. ...
www.inteligand.com
Symyx
Science - Chemistry - Software - Companies. Software and cheminformatics database programs for chemists and life scientists. ...
www.symyx.com
ID Business Solutions
Science - Chemistry - Software - Cheminformatics. Integrated framework for discovery data, from initial data capture to results analysis and reporting, to long-term data management. ...
www.idbs.com
Karypis Lab: AFGen
Science - Chemistry - Software - Cheminformatics. Software tools for generating fragment-based descriptors for chemical compounds with applications to similarity search, virtual screening and library design. ...
glaros.dtc.umn.edu
Discovery Bus
Science - Chemistry - Software - Cheminformatics. The Discovery Bus Auto-QSAR system produces continuously updated modelling and property prediction. Offers a free QSAR trial. ...
www.discoverybus.com
Molsoft L.L.C.
Science - Chemistry - Software - Companies. Provider of tools, databases and consulting services in the area of structure prediction, bioinformatics, cheminformatics, molecular visualization, and rati ...
www.molsoft.com
Digital Chemistry
Regional - Europe - United Kingdom - England - West Yorkshire - Harewood. A cheminformatics software company, which specialises in the development of tool kits and applications for chemical and pharmaceutical research. Company profile, products, consulting, support, and contacts. ...
www.digitalchemistry.co.uk
Journal of Computational Chemistry
Science - Chemistry - Computational - Journals. Publishes original articles on ab initio and semiempirical quantum mechanics, density functional theory, molecular mechanics, molecular dynamics, statis ...
www3.interscience.wiley.com
Focus Synthesis
Science - Chemistry - Organic - Products and Services. Manufacturer of synthons, building blocks and research chemicals optimized for drug discovery using cheminformatics-based design. Also offers cus ...
www.focussynthesis.com
Virtual Computational Chemistry Laboratory
Science - Chemistry - Software - Cheminformatics. Free on-line calculation of lipophilicity, logP, aqueous solubility, logS, molecular indices using Java applets. Analysis methods include neural networks, partial least squares and unsupervised forward selection. ...
www.vcclab.org
Osiris Property Explorer
Science - Chemistry - Software - Cheminformatics. Software to calculate various drug-relevant properties of chemical structures. Prediction results are given a value and color coded for such properties as toxicity and solubility. ...
www.organic-chemistry.org
GLARE
Science - Chemistry - Software - Cheminformatics. Free software that facilitates and improves the design of chemical combinatorial libraries. It automates the process of reducing vendor chemical lists based on desired product properties. ...
glare.sourceforge.net
MEDIT - Molecular Extended Distribution in Information Technology
Science - Chemistry - Software - Companies. French company working on software development and services in bioinformatics, cheminformatics and molecular modeling. Offers in-silico services for researc ...
www.medit.fr
Managed Ventures
Science - Instruments and Supplies - Laboratory Automation and Robotics - Software and Data Manipulation. Provides software development services for drug discovery applications in cheminformatics, hig ...
top
