Michal Vieth
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Detailed analysis of grid‐based molecular docking: A case study of CDOCKER—A CHARMm‐based MD docking algorithm
G Wu, DH Robertson, CL Brooks III, M Vieth
Journal of computational chemistry 24 (13), 1549-1562, 2003
Lessons in molecular recognition: the effects of ligand and protein flexibility on molecular docking accuracy
JA Erickson, M Jalaie, DH Robertson, RA Lewis, M Vieth
Journal of medicinal chemistry 47 (1), 45-55, 2004
Characteristic physical properties and structural fragments of marketed oral drugs
M Vieth, MG Siegel, RE Higgs, IA Watson, DH Robertson, KA Savin, ...
Journal of medicinal chemistry 47 (1), 224-232, 2004
Synthesis and activity of new aryl-and heteroaryl-substituted pyrazole inhibitors of the transforming growth factor-β type I receptor kinase domain
JS Sawyer, BD Anderson, DW Beight, RM Campbell, ML Jones, ...
Journal of medicinal chemistry 46 (19), 3953-3956, 2003
Kinomics—structural biology and chemogenomics of kinase inhibitors and targets
M Vieth, RE Higgs, DH Robertson, M Shapiro, EA Gragg, H Hemmerle
Biochimica et Biophysica Acta (BBA)-Proteins and Proteomics 1697 (1-2), 243-257, 2004
Assessing energy functions for flexible docking
M Vieth, JD Hirst, A Kolinski, CL Brooks III
Journal of Computational Chemistry 19 (14), 1612-1622, 1998
Kinomics: characterizing the therapeutically validated kinase space
M Vieth, JJ Sutherland, DH Robertson, RM Campbell
Drug discovery today 10 (12), 839-846, 2005
Assessing search strategies for flexible docking
M Vieth, JD Hirst, BN Dominy, H Daigler, CL Brooks III
Journal of computational chemistry 19 (14), 1623-1631, 1998
Molecular properties that influence oral drug-like behavior.
MS Lajiness, M Vieth, J Erickson
Current opinion in drug discovery & development 7 (4), 470-477, 2004
Lessons in molecular recognition. 2. Assessing and improving cross-docking accuracy
JJ Sutherland, RK Nandigam, JA Erickson, M Vieth
Journal of chemical information and modeling 47 (6), 2293-2302, 2007
Prediction of the folding pathways and structure of the GCN4 leucine zipper
M Vieth, A Kolinski, CL Brooks III, J Skolnick
Journal of molecular biology 237 (4), 361-367, 1994
Do active site conformations of small ligands correspond to low free-energy solution structures?
M Vieth, JD Hirst, CL Brooks
Journal of computer-aided molecular design 12, 563-572, 1998
Dependence of molecular properties on proteomic family for marketed oral drugs
M Vieth, JJ Sutherland
Journal of medicinal chemistry 49 (12), 3451-3453, 2006
Dynamic error correction in autocatalytic peptide networks
K Severin, DH Lee, JA Martinez, M Vieth, MR Ghadiri
Angewandte Chemie International Edition 37 (1‐2), 126-128, 1998
DoMCoSAR: A Novel Approach for Establishing the Docking Mode That Is Consistent with the Structure− Activity Relationship. Application to HIV-1 Protease Inhibitors and VEGF …
M Vieth, DJ Cummins
Journal of medicinal chemistry 43 (16), 3020-3032, 2000
Drugs in other drugs: a new look at drugs as fragments
MG Siegel, M Vieth
Drug discovery today 12 (1-2), 71-79, 2007
Chemical fragments as foundations for understanding target space and activity prediction
JJ Sutherland, RE Higgs, I Watson, M Vieth
Journal of medicinal chemistry 51 (9), 2689-2700, 2008
Design of potent and selective 2-aminobenzimidazole-based p38α MAP kinase inhibitors with excellent in vivo efficacy
A de Dios, C Shih, B López de Uralde, C Sánchez, M del Prado, ...
Journal of medicinal chemistry 48 (7), 2270-2273, 2005
Structural insights into probe-dependent positive allosterism of the GLP-1 receptor
AB Bueno, B Sun, FS Willard, D Feng, JD Ho, DB Wainscott, ...
Nature Chemical Biology 16 (10), 1105-1110, 2020
SDOCKER: a method utilizing existing X-ray structures to improve docking accuracy
G Wu, M Vieth
Journal of medicinal chemistry 47 (12), 3142-3148, 2004
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