共 50 条
- [1] Recent developments and applications of QM/MM methods with SCC-DFTB and ab initio QM methods ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2012, 244
- [3] Recent advances in QM and QM/MM methods COMPUTATIONAL SCIENCE - ICCS 2003, PT IV, PROCEEDINGS, 2003, 2660 : 75 - 83
- [6] Applications of QM, QM+MM, and QM/MM direct dynamics simulations ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 227 : U273 - U273
- [7] Recent efforts in calculating free energy based properties using QM and QM/MM methods, and progress towards better MM methods to support more accurate QM/MM free energies ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2019, 258
- [8] Recent applications of QM/MM calculations in drug discovery and hydrogen tunneling. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 228 : U235 - U235
- [9] Recent advances in the development of QM/MM free energy methods to study biocatalysis ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 252