共 50 条
- [21] Analysing enzyme mechanisms and catalysis by QM/MM modelling. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 228 : U235 - U235
- [22] Application of QM/MM Methods in Theoretical Studies of Enzyme Catalysis THEORY AND APPLICATIONS OF COMPUTATIONAL CHEMISTRY - 2008, 2009, 1102 : 114 - 121
- [23] Hybrid QM/MM simulations of enzyme reaction mechanisms. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2000, 220 : U158 - U158
- [25] Frontier bonds in QM/MM methods: A comparison of different approaches JOURNAL OF PHYSICAL CHEMISTRY A, 2000, 104 (08): : 1720 - 1735
- [27] Comparative Computational Approach To Study Enzyme Reactions Using QM and QM-MM Methods ACS OMEGA, 2018, 3 (11): : 14689 - 14703
- [29] QM/MM excited state dynamics of complex systems ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2015, 249