OPLS3: a force field providing broad coverage of drug-like small molecules and proteins E Harder, W Damm, J Maple, C Wu, M Reboul, JY Xiang, L Wang, ... Journal of chemical theory and computation 12 (1), 281-296, 2016 | 2949 | 2016 |

Current status of the AMOEBA polarizable force field JW Ponder, C Wu, P Ren, VS Pande, JD Chodera, MJ Schnieders, ... The journal of physical chemistry B 114 (8), 2549-2564, 2010 | 1490 | 2010 |

OPLS3e: Extending force field coverage for drug-like small molecules K Roos, C Wu, W Damm, M Reboul, JM Stevenson, C Lu, MK Dahlgren, ... Journal of chemical theory and computation 15 (3), 1863-1874, 2019 | 940 | 2019 |

OPLS4: Improving force field accuracy on challenging regimes of chemical space C Lu, C Wu, D Ghoreishi, W Chen, L Wang, W Damm, GA Ross, ... Journal of chemical theory and computation 17 (7), 4291-4300, 2021 | 878 | 2021 |

Polarizable atomic multipole-based AMOEBA force field for proteins Y Shi, Z Xia, J Zhang, R Best, C Wu, JW Ponder, P Ren Journal of chemical theory and computation 9 (9), 4046-4063, 2013 | 728 | 2013 |

Polarizable atomic multipole-based molecular mechanics for organic molecules P Ren, C Wu, JW Ponder Journal of chemical theory and computation 7 (10), 3143-3161, 2011 | 503 | 2011 |

AMOEBA polarizable atomic multipole force field for nucleic acids C Zhang, C Lu, Z Jing, C Wu, JP Piquemal, JW Ponder, P Ren Journal of chemical theory and computation 14 (4), 2084-2108, 2018 | 244 | 2018 |

Accurate force field development for modeling conjugated polymers KH DuBay, ML Hall, TF Hughes, C Wu, DR Reichman, RA Friesner Journal of chemical theory and computation 8 (11), 4556-4569, 2012 | 148 | 2012 |

Study on performance mechanism of pour point depressants with differential scanning calorimeter and X-ray diffraction methods☆ J Zhang, C Wu, W Li, Y Wang, Z Han Fuel 82 (11), 1419-1426, 2003 | 132 | 2003 |

Molecular dynamics simulation guiding the improvement of EVA-type pour point depressant C Wu, J Zhang, W Li, N Wu Fuel 84 (16), 2039-2047, 2005 | 129 | 2005 |

DFT and MM calculation: the performance mechanism of pour point depressants study J Zhang, C Wu, W Li, Y Wang, H Cao Fuel 83 (3), 315-326, 2004 | 92 | 2004 |

Multipole electrostatics in hydration free energy calculations Y Shi, C Wu, JW Ponder, P Ren Journal of computational chemistry 32 (5), 967-977, 2011 | 82 | 2011 |

Reintroducing electrostatics into macromolecular crystallographic refinement: application to neutron crystallography and DNA hydration TD Fenn, MJ Schnieders, M Mustyakimov, C Wu, P Langan, VS Pande, ... Structure 19 (4), 523-533, 2011 | 46 | 2011 |

Toward atomistic modeling of irreversible covalent inhibitor binding kinetics HS Yu, C Gao, D Lupyan, Y Wu, T Kimura, C Wu, L Jacobson, E Harder, ... Journal of Chemical Information and Modeling 59 (9), 3955-3967, 2019 | 34 | 2019 |

Artificial neural network model to predict cold filter plugging point of blended diesel fuels C Wu, J Zhang, W Li, Y Wang, H Cao Fuel processing technology 87 (7), 585-590, 2006 | 32 | 2006 |

Molecular dynamics of β-hairpin models of epigenetic recognition motifs X Zheng, C Wu, JW Ponder, GR Marshall Journal of the American Chemical Society 134 (38), 15970-15978, 2012 | 28 | 2012 |

Prediction of Henry's law constants of small gas molecules in liquid ethylene oxide and ethanol using force field methods C Wu, X Li, J Dai, H Sun Fluid phase equilibria 236 (1-2), 66-77, 2005 | 27 | 2005 |

降凝剂分子设计的研究进展 张金利， 梁瑛 化工进展 21 (004), 239-242, 2002 | 19 | 2002 |

Schr\" odinger-ANI: An Eight-Element Neural Network Interaction Potential with Greatly Expanded Coverage of Druglike Chemical Space JM Stevenson, LD Jacobson, Y Zhao, C Wu, J Maple, K Leswing, ... arXiv preprint arXiv:1912.05079, 2019 | 18 | 2019 |

Prediction of the heat of mixing for binary fluids using molecular dynamics simulation J Dai, C Wu, X Bao, H Sun Fluid phase equilibria 236 (1-2), 78-85, 2005 | 18 | 2005 |