GPU_Apps_Catalog_Mar5_WEB_Singles_pdf.docVIP

Research: Higher Education and Supercomputing COMPUTATIONAL CHEMISTRY AND BIOLOGY Molecular Dynamics APPLICATION DESCRIPTION SUPPORTED FEATURES MULTI-GPU SUPPORT ACEMD GPU 的分子力学模拟 部队涉及，隐式和显式溶剂 Written for use only on GPUs Yes AMBER CHARMM 程序来模拟分子套件 生物分子动力学 PMEMD Explicit Solvent and GB Implicit Solvent Yes Yes MD 包来模拟分子 生物分子动力学 Implicit (5x), Explicit (2x) Solvent via OpenMM. Native CUDA port in development DESMOND DL-POLY Folding@Home High-speed molecular dynamics simulations of biological systems on conventional commodity clusters. The code uses novel parallel algorithms and numerica