http://rdf.ncbi.nlm.nih.gov/pubchem/patent/JP-2022103481-A
Outgoing Links
| Predicate | Object |
|---|---|
| assignee | http://rdf.ncbi.nlm.nih.gov/pubchem/patentassignee/MD5_e5db580deca7130dbe51805c6c608b35 |
| classificationCPCInventive | http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16B5-00 http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16C10-00 http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16B15-00 http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16C20-30 http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16B15-30 |
| classificationIPCInventive | http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/G06N99-00 http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/C12M1-34 |
| filingDate | 2020-12-28-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| inventor | http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_5c18f0dfd026460c94beb13ba01d8832 |
| publicationDate | 2022-07-08-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| publicationNumber | JP-2022103481-A |
| titleOfInvention | Cyclic peptide stable structure search method, cyclic peptide stable structure search program, and cyclic peptide stable structure search device |
| abstract | PROBLEM TO BE SOLVED: To provide a method for searching a stable structure of a cyclic peptide, which can appropriately sample the structure of a cyclic peptide and appropriately search for a stable structure of the cyclic peptide. A method for searching for a stable structure of a cyclic peptide, which comprises sampling the structure of a cyclic peptide, wherein a biplane angle ω between a carbon atom and a nitrogen atom forming a peptide bond in the cyclic peptide is used. A method for searching for a stable structure of a cyclic peptide, in which a computer performs the sampling, using a trans-type cyclic peptide structure having a temperature of 150 ° or more and 210 ° or less as the initial structure of the first molecule simulation. [Selection diagram] FIG. 11 |
| priorityDate | 2020-12-28-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| type | http://data.epo.org/linked-data/def/patent/Publication |
Incoming Links
Total number of triples: 23.