共 50 条
- [1] Semiempirical methods for biological reactions: New models, QM/MM and linear-scaling applications to RNA catalysis. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 227 : U911 - U911
- [2] Polarizable QM/MM based on the AMOEBA force field and linear-scaling DFT ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2015, 250
- [3] Polarizable QM/MM based on the AMOEBA force field and linear-scaling DFT ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 252
- [4] Polarizable QM/MM based on the AMOEBA force field and linear-scaling DFT ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 251
- [5] Comparative studies for evaluation of CO2 fixation in the cavity of the Rubisco enzyme using QM, QM/MM and linear-scaling DFT methods Journal of Molecular Modeling, 2013, 19 : 2329 - 2334
- [7] TINKTEP: Polarizable QM/MM based on linear-scaling DFT and the AMOEBA force field ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253
- [9] Recent advances in QM and QM/MM methods COMPUTATIONAL SCIENCE - ICCS 2003, PT IV, PROCEEDINGS, 2003, 2660 : 75 - 83