The standard molecular data format (SMD format) as an integration tool in computer chemistry.
H. BebakC. BuseWolfgang T. DonnerP. HoeverH. JacobH. KlausJ. PeschJ. RoemeltP. SchillingPublished in: J. Chem. Inf. Comput. Sci. (1989)
Keyphrases
- data sets
- data analysis
- image data
- data collection
- computer systems
- raw data
- high quality
- multimedia
- training data
- experimental data
- high dimensional data
- knowledge discovery
- databases
- statistical methods
- missing data
- statistical analysis
- data processing
- database
- data points
- cost function
- synthetic data
- prior knowledge
- domain experts
- spatial data
- data structure
- web pages
- feature selection
- data quality
- xml format
- human readable