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Journal Abstract Search

175 related items for PubMed ID: 32208716

  • 1. Combining the Fragmentation Approach and Neural Network Potential Energy Surfaces of Fragments for Accurate Calculation of Protein Energy.
    Wang Z, Han Y, Li J, He X.
    J Phys Chem B; 2020 Apr 16; 124(15):3027-3035. PubMed ID: 32208716
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  • 2. Full QM Calculation of RNA Energy Using Electrostatically Embedded Generalized Molecular Fractionation with Conjugate Caps Method.
    Jin X, Zhang JZ, He X.
    J Phys Chem A; 2017 Mar 30; 121(12):2503-2514. PubMed ID: 28264557
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  • 3. Electrostatically embedded generalized molecular fractionation with conjugate caps method for full quantum mechanical calculation of protein energy.
    Wang X, Liu J, Zhang JZ, He X.
    J Phys Chem A; 2013 Aug 15; 117(32):7149-61. PubMed ID: 23452268
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  • 7. An improved fragment-based quantum mechanical method for calculation of electrostatic solvation energy of proteins.
    Jia X, Wang X, Liu J, Zhang JZ, Mei Y, He X.
    J Chem Phys; 2013 Dec 07; 139(21):214104. PubMed ID: 24320361
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  • 8. Fragment-Based Quantum Mechanical Calculation of Excited-State Properties of Fluorescent RNAs.
    Shen C, Wang X, He X.
    Front Chem; 2021 Dec 07; 9():801062. PubMed ID: 35004616
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  • 15. Fragment quantum chemical approach to geometry optimization and vibrational spectrum calculation of proteins.
    Liu J, Zhang JZ, He X.
    Phys Chem Chem Phys; 2016 Jan 21; 18(3):1864-75. PubMed ID: 26686896
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  • 16. A Fragment Quantum Mechanical Method for Metalloproteins.
    Xu M, He X, Zhu T, Zhang JZH.
    J Chem Theory Comput; 2019 Feb 12; 15(2):1430-1439. PubMed ID: 30620584
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  • 18. Quantum Fragment Based ab Initio Molecular Dynamics for Proteins.
    Liu J, Zhu T, Wang X, He X, Zhang JZ.
    J Chem Theory Comput; 2015 Dec 08; 11(12):5897-905. PubMed ID: 26642993
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