{"schema_version":"1.0","canonical_url":"https://patentable.app/patents/US-9727690","patent":{"patent_number":"US-9727690","title":"Method and system for molecular dynamics simulation with stability control","assignee":null,"inventors":[],"filing_date":"2012-12-21T00:00:00.000Z","publication_date":"2017-08-08T00:00:00.000Z","cpc_codes":["G16B","G16B","G16B"],"num_claims":12,"abstract":"The present invention is applicable in the field of molecular dynamics, said invention consisting of computing methods for predicting the structure and function of biomolecules, and particularly of proteins, by means of simulating the protein folding process and the interaction process of proteins with other biomolecules in a solvent. More particularly, the invention relates to a method and a system for controlling simulation stability and for choosing the timestep used in the numerical integration of the equations of motion. The invention successfully reduces the molecular dynamics simulation time by means of optimizing the timestep choice through an adaptive control or allowing larger timesteps correcting the trajectories based on a power control."},"analysis":{"summary":null,"layman_explanation":null,"technical_analysis":null,"business_analysis":null,"faqs":null,"topics":[],"tech_cluster":null},"seo":{"title":"Method and system for molecular dynamics simulation with stability control","description":"The present invention is applicable in the field of molecular dynamics, said invention consisting of computing methods for predicting the structure and function of biomolecules, and particularly of pr","keywords":[]},"attribution":{"source":"Patentable","source_url":"https://patentable.app","canonical_url":"https://patentable.app/patents/US-9727690","license":"CC-BY-4.0-like","license_terms":"AI-generated analysis on this page (summary, layman_explanation, technical_analysis, business_analysis, faqs) may be reused with attribution and a visible link back to the canonical URL above. Patent abstracts, claims, and bibliographic data are USPTO public domain.","required_link":"https://patentable.app/patents/US-9727690","citation_suggestion":"Patentable. \"Method and system for molecular dynamics simulation with stability control\" (US-9727690). https://patentable.app/patents/US-9727690","copyright_holder":"Nomic Interactive Technology LLC"},"links":{"html":"https://patentable.app/patents/US-9727690","json":"https://patentable.app/api/llm-context/US-9727690","site":"https://patentable.app","llms_txt":"https://patentable.app/llms.txt"},"generated_at":"2026-06-06T11:38:48.197Z"}