What is the current value of MM/PBSA and MM/GBSA methods in drug discovery? 论文

2021Expert Opinion on Drug Discovery引用 276

Computational Drug Discovery MethodsProtein Structure and DynamicsReceptor Mechanisms and Signaling

Protein Structure and Dynamics Computational Drug Discovery Methods Receptor Mechanisms and Signaling

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1. Introduction\n2. MM/PB(GB)SA methods\n3.MM/PB(GB)SA applications\n3.1. Ligand-binding orientation\n3.2. Virtual screening studies\n3.3. QM/PB(GB)SA method\n3.4. Macromolecular interactions\n4. Expert opinion

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Tiziano Tuccinardi

What is the current value of MM/PBSA and MM/GBSA methods in drug discovery? 论文

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