Molecular structure - Computer simulation.

Computer-based structure elucidation from spectral data = the art of solving problems / by: (書目-語言資料,印刷品)

Hybrid Methods of Molecular Modeling by: (書目-語言資料,印刷品)

Computational chemistry = introduction to the theory and applications of molecular and quantum mechanics / by: (書目-語言資料,印刷品)

De novo molecular design by: (書目-語言資料,印刷品)

Computer modelling in inorganic crystallography by: (書目-語言資料,印刷品)

Quantum chemistry

Chemistry

Molecules

Inorganic compounds

Molecular structure

Spectroscopy/Spectrometry.

Computer Appl. in Life Sciences.

Chemistry, Physical and theoretical

Chemistry.

Nanotechnology.

Structural bioinformatics.

Computer Applications in Chemistry.

Spectrum analysis

Cheminformatics.

Physical Chemistry.

Materials Science.

Theoretical and Computational Chemistry.

Crystallography

Organic Chemistry.