## Abstract We describe a complete implementation of allβatom protein molecular dynamics running entirely on a graphics processing unit (GPU), including all standard force field terms, integration, constraints, and implicit solvent. We discuss the design of our algorithms and important optimization
β¦ LIBER β¦
Accelerating spectral atomic and molecular collisions methods with graphics processing units
β Scribed by Colavecchia, F.D.
- Book ID
- 122283622
- Publisher
- Elsevier Science
- Year
- 2014
- Tongue
- English
- Weight
- 668 KB
- Volume
- 185
- Category
- Article
- ISSN
- 0010-4655
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