A Generalized Hybrid Orbital (GHO) Method for the Treatment of Boundary Atoms in Combined QM/MM Calculations

✍ Scribed by Gao, Jiali; Amara, Patricia; Alhambra, Cristobal; Field, Martin J.

• Book ID: 124051290
• Publisher: American Chemical Society
• Year: 1998
• Tongue: English
• Weight: 420 KB
• Volume: 102
• Category: Article
• ISSN: 1089-5639
• DOI: 10.1021/jp9809890