Patents by Inventor Matthias Rarey

Matthias Rarey has filed for patents to protect the following inventions. This listing includes patent applications that are pending as well as patents that have already been granted by the United States Patent and Trademark Office (USPTO).

  • Patent number: 8688387
    Abstract: The present invention relates to the determination of intra- or intermolecular interaction between molecules in aqueous solution, the method comprising the steps of: (a) determining the dehydration of all atoms in the intermolecular interface, (b) adding the vacuum hydrogen bond energy, and (c) further adding the change in the free enthalpy of the interacting partners upon their interaction. The obtained results can be used for the prediction if and to what extent two molecules of various origin fit to each other.
    Type: Grant
    Filed: February 6, 2012
    Date of Patent: April 1, 2014
    Assignees: Bayer CropScience AG, Universitaet Hamburg
    Inventors: Gudrun Lange, Robert Klein, Juergen Albrecht, Matthias Rarey, Ingo Reulecke
  • Publication number: 20120202699
    Abstract: The present invention relates to the determination of intra- or intermolecular interaction between molecules in aqueous solution, the method comprising the steps of: (a) determining the dehydration of all atoms in the intermolecular interface, (b) adding the vacuum hydrogen bond energy, and (c) further adding the change in the free enthalpy of the interacting partners upon their interaction. The obtained results can be used for the prediction if and to what extent two molecules of various origin fit to each other.
    Type: Application
    Filed: February 6, 2012
    Publication date: August 9, 2012
    Applicants: UNIVERSITAET HAMBURG, BAYER CROPSCIENCE AG
    Inventors: Gudrun Lange, Robert Klein, Juergen Albrecht, Matthias Rarey, Ingo Reulecke
  • Publication number: 20100273664
    Abstract: The present invention relates to the determination of intra- or intermolecular interaction between molecules in aqueous solution, said method comprising the steps of: (a) determining the dehydration (?Gdehydration) of all atoms in the intermolecular interface, (b) adding the vacuum hydrogen bond energy (?H-bond), and (c) further adding the change in the free enthalpy of the interacting partners upon their interaction. The obtained results can be used for the prediction if and to what extent two molecules of various origin fit to each other.
    Type: Application
    Filed: October 20, 2007
    Publication date: October 28, 2010
    Applicants: BAYER CROPSCIENCE AG, UNIVERSITAET HAMBURG
    Inventors: Gudrun Lange, Robert Klein, Juergen Albrecht, Matthias Rarey, Ingo Reulecke
  • Publication number: 20090306902
    Abstract: A method for structure-based virtual screening, wherein compounds for investigation are categorized or sorted into a catalog according to their physicochemical and steric properties. The physicochemical and steric properties of a target are determined, the part(s) of the catalog which match the determined properties of the target are determined, and only the compounds in these parts of the catalog are screened against the target.
    Type: Application
    Filed: December 20, 2006
    Publication date: December 10, 2009
    Applicant: BIOSOLVEIT GMBH
    Inventors: Christian Lemmen, Matthias Rarey, Ingo Schellhammer