cheminformatics love

cheminformatics

Definitions

from Wiktionary, Creative Commons Attribution/Share-Alike License.

  • noun chemistry, computing Any of many applications of information technology to chemistry

Etymologies

from Wiktionary, Creative Commons Attribution/Share-Alike License

chem- +‎ informatics

Examples

  • Labels: cheminformatics, chemistry, Indiana, lecture, Open Notebook Science posted by Jean-Claude Bradley at

    Archive 2008-03-01

  • I guest lectured on Rajarshi Guha's cheminformatics course at Indiana University on March 25, 2008.

    Open Notebook Science and Cheminformatics

  • I guest lectured on Rajarshi Guha's cheminformatics course at Indiana University on March 25, 2008.

    Archive 2008-03-01

  • Labels: cheminformatics, chemistry, Indiana, lecture, Open Notebook Science posted by Jean-Claude Bradley at

    Open Notebook Science and Cheminformatics

  • The use cheminformatics tools such as SMILES, InChI, InChIKeys and JCAMP-DX to store and retrieve experimental information on a public laboratory notebook is detailed. audio (mp3)

    ACS Talk on Cheminformatics in Open Notebook Science

  • The use cheminformatics tools such as SMILES, InChI, InChIKeys and JCAMP-DX to store and retrieve experimental information on a public laboratory notebook is detailed. audio (mp3)

    Archive 2008-04-01

  • If you are sure your cheminformatics representation is in order, I welcome a bug report here.

    Bioclipse for CDK Developers #1

  • Peter had a detailed blog about why he joined the editorial board:I take this position with some trepidation as I have grave reservations about the current practice of cheminformatics.

    Archive 2009-03-01

  • I am not sure if this involves open source cheminformatics, but asked about that... the whole article is worth reading.

    ELN vendor: "The Open Source stuff just works better"

  • In cheminformatics it is even often the case that the algorithms are not even specified and that there only truly is source.

    Archive 2009-05-01

Comments

Log in or sign up to get involved in the conversation. It's quick and easy.