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Chemistry by Computer [E-Book] : An Overview of the Applications of Computers in Chemistry /
Table of Contents: ...I. Basics -- 1. Introduction -- 2. Chemistry by Computer. -- 3. Computers and Computation -- II. Methods -- 4. Quantum Chemistry -- 5. Molecular Mechanics -- 6. Chemical Reactions -- 7. Simulation of Liquids and Solids -- III. Applications -- 8...

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