Dependency of ligand free energy landscapes on charge parameters and solvent models.
- Published in:
- Journal of Computer-Aided Molecular Design, 2010, v. 24, n. 8, p. 699, doi. 10.1007/s10822-010-9367-z
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- Publication type:
- Article
Works matching IS 0920654X AND DT 2010 AND VI 24 AND IP 8
Results: 6
1
2
A computational analysis of the binding model of MDM2 with inhibitors.
- Published in:
- Journal of Computer-Aided Molecular Design, 2010, v. 24, n. 8, p. 687, doi. 10.1007/s10822-010-9366-0
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- Publication type:
- Article
3
Allosteric antagonist binding sites in class B GPCRs: corticotropin receptor 1.
- Published in:
- Journal of Computer-Aided Molecular Design, 2010, v. 24, n. 8, p. 659, doi. 10.1007/s10822-010-9364-2
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- Publication type:
- Article
4
Dynamic clustering threshold reduces conformer ensemble size while maintaining a biologically relevant ensemble.
- Published in:
- Journal of Computer-Aided Molecular Design, 2010, v. 24, n. 8, p. 675, doi. 10.1007/s10822-010-9365-1
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- Publication type:
- Article
5
Prediction of protein–ligand binding affinity by free energy simulations: assumptions, pitfalls and expectations.
- Published in:
- Journal of Computer-Aided Molecular Design, 2010, v. 24, n. 8, p. 639, doi. 10.1007/s10822-010-9363-3
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- Publication type:
- Article
6
Cyclodextrin knowledgebase a web-based service managing CD-ligand complexation data.
- Published in:
- Journal of Computer-Aided Molecular Design, 2010, v. 24, n. 8, p. 713, doi. 10.1007/s10822-010-9368-y
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- Publication type:
- Article