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Automated Design Product List

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Automatic design of protein binders in DiscoveryStudio.

Automatic design of protein binders in DiscoveryStudio.

Automatic design of protein binder structures using AI!

In recent years, functional protein binders have become important in drug discovery for controlling and exploring protein functions. However, their design is very complex and not easy, even with the use of generative AI. However, with Discovery Studio, it is possible to automatically design the structure and sequence of binders in an all-in-one approach. The execution steps are quite simple. - Molecular structure of the target protein - Residues at the interaction site (when a specific target is chosen) - Size of the binder to be designed You only need to set the three points above. Data regarding the structure and sequence of the binder is generated from scratch, and candidates that meet the minimum design requirements are explored. Furthermore, the discovered candidates are evaluated using a scoring function, improved iteratively to enhance the scores, and ultimately, the "desired parameter set" and "the complex structure of the binder and target" are listed along with their scores. For a detailed technical explanation, please visit our introduction page below! https://www.wavefront.co.jp/tech-blog/posts/ai-assisted-design.html

  • Protein Analysis Software
  • Other protein analysis
  • Other Protein Research
  • Automated Design

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[TechBlog] AI Drug Discovery: Automated Design of Protein-Binding Agents

[TechBlog] AI Drug Discovery: Automated Design of Protein-Binding Agents

Integrating RFdiffusion, ProteinMPNN, and AlphaFold2! Automatic design of protein binders using AI.

"BIOVIA Discovery Studio" is an integrated software that supports molecular modeling and simulation in drug discovery and life sciences research. It also accommodates the automated design of protein binders using generative AI. In "Design Protein Binders," AI technologies such as RFdiffusion, ProteinMPNN, and AlphaFold2 are integrated to de novo design the structure and sequence of novel proteins that bind to target proteins. Users can specify targets, hotspots, and the size of binders, and execute automated design using GPU resources on the 3DEXPERIENCE cloud. Generated candidates can be evaluated using pLDDT, PAE, iPAE, RMSD, and analyses of protein-protein interactions and structural stability are also supported. 【Features】 ■ De novo design of protein structures and sequences using generative AI ■ Integration of RFdiffusion, ProteinMPNN, and AlphaFold2 ■ All-in-one design of protein binder structures and sequences ■ Support for scoring design candidates and PPI analysis *For more details, please feel free to contact us.

  • Software (middle, driver, security, etc.)
  • Other Protein Research Software
  • Automated Design

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Must-see for those considering business improvement! Inspection and quality control, anomaly detection, material picking, automated design.

Must-see for those considering business improvement! Inspection and quality control, anomaly detection, material picking, automated design.

[Case Study] A must-see for those considering business improvement using AI in the manufacturing industry! Capable of solving various business challenges!

Introducing Systems Nakashima's AI utilization solutions. By combining 35 years of CAD development know-how with AI, we enable material aggregation and automatic design through "AI × Drawings, Material Takeoff, Automatic Design." Additionally, by training the AI on various situations that may occur during normal operations, we can recognize unusual actions and issue security alerts with "AI × Classification, Identification, Anomaly Detection." This allows for significant reductions in labor hours and the resolution of various business challenges related to safety and quality management. In addition to developing systems that improve operational efficiency using AI, we provide comprehensive support from organizing training data to building AI models and integrating them into systems. Please feel free to consult with us. 【AI Utilization Solutions】 ■ "AI × Drawings, Material Takeoff, Automatic Design" enabling material aggregation and automatic design. ■ "AI × Inspection and Quality Control," an object detection model that streamlines the learning process through transfer learning. ■ "AI × Classification, Identification, Anomaly Detection," where AI recognizes unusual actions and issues security alerts. *For more details, please feel free to contact us.

  • Software (middle, driver, security, etc.)
  • Automated Design

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