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Journal Abstract Search
264 related items for PubMed ID: 20101644
1. Use of the FACTS solvation model for protein-ligand docking calculations. Application to EADock. Zoete V, Grosdidier A, Cuendet M, Michielin O. J Mol Recognit; 2010; 23(5):457-61. PubMed ID: 20101644 [Abstract] [Full Text] [Related]
7. SwissParam: a fast force field generation tool for small organic molecules. Zoete V, Cuendet MA, Grosdidier A, Michielin O. J Comput Chem; 2011 Aug 28; 32(11):2359-68. PubMed ID: 21541964 [Abstract] [Full Text] [Related]
8. Accuracy comparison of several common implicit solvent models and their implementations in the context of protein-ligand binding. Katkova EV, Onufriev AV, Aguilar B, Sulimov VB. J Mol Graph Model; 2017 Mar 28; 72():70-80. PubMed ID: 28064081 [Abstract] [Full Text] [Related]
14. FDS: flexible ligand and receptor docking with a continuum solvent model and soft-core energy function. Taylor RD, Jewsbury PJ, Essex JW. J Comput Chem; 2003 Oct 28; 24(13):1637-56. PubMed ID: 12926007 [Abstract] [Full Text] [Related]
15. A comprehensive docking study on the selectivity of binding of aromatic compounds to proteins. Hetényi C, Maran U, Karelson M. J Chem Inf Comput Sci; 2003 Oct 28; 43(5):1576-83. PubMed ID: 14502492 [Abstract] [Full Text] [Related]
16. Docking to heme proteins. Röhrig UF, Grosdidier A, Zoete V, Michielin O. J Comput Chem; 2009 Nov 15; 30(14):2305-15. PubMed ID: 19288474 [Abstract] [Full Text] [Related]
17. Prediction of the binding energy for small molecules, peptides and proteins. Schapira M, Totrov M, Abagyan R. J Mol Recognit; 1999 Nov 15; 12(3):177-90. PubMed ID: 10398408 [Abstract] [Full Text] [Related]
20. Application of the frozen atom approximation to the GB/SA continuum model for solvation free energy. Guvench O, Weiser J, Shenkin P, Kolossváry I, Still WC. J Comput Chem; 2002 Jan 30; 23(2):214-21. PubMed ID: 11924735 [Abstract] [Full Text] [Related] Page: [Next] [New Search]