WONKA: objective novel complex analysis for ensembles of protein-ligand structures.
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- Journal of Computer-Aided Molecular Design, 2015, v. 29, n. 10, p. 963, doi. 10.1007/s10822-015-9866-z
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- Publication type:
- Article
Works matching IS 0920-654X AND VI 29 AND IP 10 AND DT 2015
Results: 6
1
2
A consistent S-Adenosylmethionine force field improved by dynamic Hirshfeld-I atomic charges for biomolecular simulation.
- Published in:
- Journal of Computer-Aided Molecular Design, 2015, v. 29, n. 10, p. 951, doi. 10.1007/s10822-015-9864-1
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- Publication type:
- Article
3
Design of chemical space networks using a Tanimoto similarity variant based upon maximum common substructures.
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- Journal of Computer-Aided Molecular Design, 2015, v. 29, n. 10, p. 937, doi. 10.1007/s10822-015-9872-1
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- Publication type:
- Article
4
The statistics of virtual screening and lead optimization.
- Published in:
- Journal of Computer-Aided Molecular Design, 2015, v. 29, n. 10, p. 923, doi. 10.1007/s10822-015-9861-4
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- Publication type:
- Article
5
Docking simulations suggest that all- trans retinoic acid could bind to retinoid X receptors.
- Published in:
- Journal of Computer-Aided Molecular Design, 2015, v. 29, n. 10, p. 975, doi. 10.1007/s10822-015-9869-9
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- Publication type:
- Article
6
Ultrafast protein structure-based virtual screening with Panther.
- Published in:
- Journal of Computer-Aided Molecular Design, 2015, v. 29, n. 10, p. 989, doi. 10.1007/s10822-015-9870-3
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- Publication type:
- Article