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5. Replica Exchange Gaussian Accelerated Molecular Dynamics: Improved Enhanced Sampling and Free Energy Calculation. Huang YM; McCammon JA; Miao Y J Chem Theory Comput; 2018 Apr; 14(4):1853-1864. PubMed ID: 29489349 [TBL] [Abstract][Full Text] [Related]
6. Multiple Parameter Replica Exchange Gaussian Accelerated Molecular Dynamics for Enhanced Sampling and Free Energy Calculation of Biomolecular Systems. Hasse T; Huang YM J Chem Theory Comput; 2024 Aug; 20(15):6485-6499. PubMed ID: 39085770 [TBL] [Abstract][Full Text] [Related]
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11. Sigmoid Accelerated Molecular Dynamics: An Efficient Enhanced Sampling Method for Biosystems. Zhao Y; Zhang J; Zhang H; Gu S; Deng Y; Tu Y; Hou T; Kang Y J Phys Chem Lett; 2023 Feb; 14(4):1103-1112. PubMed ID: 36700836 [TBL] [Abstract][Full Text] [Related]
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13. Gaussian accelerated molecular dynamics for elucidation of drug pathways. Bhattarai A; Miao Y Expert Opin Drug Discov; 2018 Nov; 13(11):1055-1065. PubMed ID: 30371112 [TBL] [Abstract][Full Text] [Related]
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