共 50 条
- [2] NAMD's enhanced sampling techniques applied to QM/MM simulations ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2018, 256
- [4] QwikMD: Gateway for easy simulation with VMD and NAMD ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2018, 256
- [5] Applications of QM, QM+MM, and QM/MM direct dynamics simulations ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2004, 227 : U273 - U273
- [7] QM/MM simulations of carbohydrates NMR SPECTROSCOPY AND COMPUTER MODELING OF CARBOHYDRATES: RECENT ADVANCES, 2006, 930 : 186 - 202
- [8] A VMD Plugin for NAMD Simulations on Amazon EC2 PROCEEDINGS OF THE INTERNATIONAL CONFERENCE ON COMPUTATIONAL SCIENCE, ICCS 2012, 2012, 9 : 136 - 145
- [10] Predicting chemical shielding in proteins: A QM/MM study combined with MD simulations ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2005, 229 : U790 - U790