Category:Computational chemistry
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This category has the following 2 subcategories, out of 8 total.
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Pages in category "Computational chemistry"
The following 53 pages are in this category, out of 153 total. This list may not reflect recent changes.
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- SAMPL Challenge
- Scigress
- Scoring functions for docking
- Self-avoiding walk
- Semiclassical physics
- Sequential structure alignment program
- Sergey Piletsky
- Shifted force method
- Slater determinant
- Slater–Condon rules
- Slater-type orbital
- Solvent model
- Spin contamination
- Stochastic process rare event sampling
- Substructure search