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Keyword [force field fitting]
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1. Molecular Mechanics Force Field Fitting In Theoretical Investigations On The Catalytic Mechanisms Of Chalcone Synthase
2. Simulations Of Gas Adsorption In Porous Crystals Using First-Principles-derived Force Field
3. Theoretical Investigation Of The Topology And Gas Adsorption Of The Ionic Covalent Organic Frameworks(ICOFs)
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