A fast SHAKE algorithm to solve distance constraint equations for small molecules in molecular dynamics simulations

✍ Scribed by Vincent Kräutler; Wilfred F. van Gunsteren; Philippe H. Hünenberger

• Publisher: John Wiley and Sons
• Year: 2001
• Tongue: English
• Weight: 174 KB
• Volume: 22
• Category: Article
• ISSN: 0192-8651
• DOI: 10.1002/1096-987x(20010415)22:5<501::aid-jcc1021>3.0.co;2-v