Patent ID: 11942188
Assignee: UCB BIOPHARMA SRL
Field: Computer technology (Electrical engineering)
Classification: CPC G  C  Y | IPC C  G

Claim 16:
17. The method according to claim 1, wherein the information about non-bonding, intra-molecular or inter-molecular atom to atom contacts further comprises contextual data about the reference iota atom relative to the reference theta atom, and wherein the contextual data contains contextual information concerning a local environment of each contact pair in the theta contact set, including one or more of: secondary structure, amino acid types or other monomer types comprising the contact pair, adjacent monomer units or local geometry thereof in a polymer chain either side of the contact, adjacent amino acids in a polypeptide chain on either side of the contact, local geometry of the adjacent monomer units or amino acids, temperature factor of the reference theta atom, temperature factor of the reference iota atom, accessible surface area of the reference theta atom, accessible surface area of the reference iota atom, a number of different reference iota atom contacts for the particular reference theta atom, or a number of other reference theta atoms on the same monomer unit as the reference theta atom.