isomerdesign.com
TiHKAL · info | home
http://isomerdesign.com/TiHKAL
TiHKAL info. PiHKAL info. TiHKAL info. TiHKAL info is a visual index and map of “. Rdquo; by Alexander and Ann Shulgin. In. The authors continue their exploration (begun in “. A Chemical Love Story. Rdquo;) of the chemistry and transformative power of psychedelic drugs, devoting this volume to tryptamines, β-carbolines, and LSD analogues. TiHKAL info Statistics. Recommended · Exemplary · Cool. Rational exploration of the underground. Absorbing bits of material.
onsnetwork.org
chem-bla-ics
http://onsnetwork.org/chemblaics
EW8: replacing CAS registry numbers with free ChEBI identifiers. CAS registry numbers can be replaced with free ChEBI identifiers. The goal of this experiment is to replace CAS registry numbers with ChEBI identifiers for which many more mappings are available in BridgeDb-provided identifier mapping files. Generate a list of gpml:DataNode s with CAS registry data sources on WikiPathways. For each, verify the chemical identity with the CAS reference database common-chemistry.org. December 7, 2014. To inter...
ambinter.com
Why using Ambinter ?
http://www.ambinter.com/why-using-ambinter
A supplier of advanced chemicals worldwide. Create a new account. Search and Inquire chemicals online. Screening compounds, Building blocks, Natural products, Custom synthesis. Search, Select and Inquire. 20 million chemicals online. Reference, SMILES, CAS number. Quick and simple 3 steps process. With 20 millions structures commercially available and frequently updated. By ambinter references, SMILES or IUPAC chemical names (using OPSIN software. Select and Add to cart. The ones you want to inquire.
ambinter.com
Help
http://www.ambinter.com/help
A supplier of advanced chemicals worldwide. Create a new account. Search and Inquire chemicals online. Screening compounds, Building blocks, Natural products, Custom synthesis. Search, Select and Inquire. 20 million chemicals online. Reference, SMILES, CAS number. Help: how to use Ambinter website? With Ambinter website, you can search, select and inquire molecules directly online. Our home page allows you to search in our 20 millions compounds database by text. By drawing a molecule. It is a notation us...
nextmovesoftware.com
NextMove Software
https://nextmovesoftware.com/blog
When compression makes things bigger. Comparing structural fingerprints using a literature-based similarity benchmark. Fishing for matched series in a sea of structure representations. Supporting the updated Symbol Nomenclature for Glycans (SNFG). When compression makes things bigger – NextMove Software. On Sugar&Splice supports PubChem’s support for biologics. Sketchy Sketches – NextMove Software. On Patently wrong – Tracing the origin of an unusual molecule in PubChem. SCSR) in Sugar&Splice. An obvious...
nextmovesoftware.com
NextMove Software | About Us
https://www.nextmovesoftware.com/about.html
General Inquiries: info@nextmovesoftware.com. NextMove Software was founded in 2010 to develop next-generation chemoinformatics solutions to pharmaceutical industry problems. The company is located on the Cambridge Science Park in the United Kingdom. For updates, you can follow NextMove Software on SlideShare. Roger A. Sayle, Ph.D., CEO and Founder. Daniel M. Lowe, Ph.D., Senior Software Engineer. An Open Parser for Systematic IUPAC Nomenclature and the automated extraction of reactions from patents.
efficientbits.blogspot.com
Efficient Bits: September 2014
http://efficientbits.blogspot.com/2014_09_01_archive.html
Friday, 12 September 2014. The latest release of the CDK (1.5.8) includes a new generator for rendering structure diagrams. A detailed introduction to configuring the new generator is available on the CDK wiki. ChEBI's current entity of the month. Will be used to demonstrate the sizing. Three parameters that are important in the overall sizing of depictions. These are the. Which are all registered as. Is not needed if we allow our diagram to be fitted automatically. Is set during diagram generation.
baldurweb.com
www.openmolecules.org
http://www.baldurweb.com/name2structure.html
Free services all around molecules. This page lets you easily convert compound names, IUPAC names, SMILES codes and CAS numbers into chemical structures. On the back end it employs the OPSIN. Java library from the University of Cambridge, the CACTUS. Online service provided by the National Cancer Institute and openmolecules software. 3D structure images are random low energy conformers rendered on-the-fly using the ray tracing engine SunFlow (see example below). Substance name, CAS-No, Smiles:.
xlat-perl.blogspot.com
The Xlat Project: Analysis of chemical names
http://xlat-perl.blogspot.com/2014/06/analysis-of-chemical-names.html
Sunday, June 8, 2014. Analysis of chemical names. Turns out the linguistic structure of chemical names is non-trivial. Unfortunately, as it's also quite profitable, it all seems to be behind paywalls, but I'm visiting Bloomington this summer and will have the opportunity to spend some time in the library, so this is one of the things I hope to make some headway on. In the meantime, here's a paywalled article. Ah - silly me. A search on "Name Struct open source" quickly returns OPSIN.
www-pmr.ch.cam.ac.uk
OSCAR4 Launch - Murray-Rust Group
http://www-pmr.ch.cam.ac.uk/wiki/OSCAR4_Launch
Log in with Raven. Centre for Molecular Science Informatics. Open Source Chemistry Analysis Routines) is an open source extensible system for the automated annotation of chemistry in scientific articles. It can be used to identify chemical names, reaction names, ontology terms, enzymes and chemical prefixes and adjectives. In addition, where possible, any chemical names detected will be annotated with structures derived either by lookup, or name-to-structure parsing using OPSIN [1]. 1225 - BalaKrishna Ko...
