Faver JC - Search Results

1

Computationally-guided optimization of small-molecule inhibitors of the Aurora A kinase-TPX2 protein-protein interaction.

Cole DJ, Janecek M, Stokes JE, Rossmann M, Faver JC, McKenzie GJ, Venkitaraman AR, Hyvönen M, Spring DR, Huggins DJ, Jorgensen WL. Cole DJ, et al. Among authors: faver jc. Chem Commun (Camb). 2017 Aug 17;53(67):9372-9375. doi: 10.1039/c7cc05379g. Chem Commun (Camb). 2017. PMID: 28787041 Free PMC article.

2

Structure-Guided Identification of DNMT3B Inhibitors.

Newton AS, Faver JC, Micevic G, Muthusamy V, Kudalkar SN, Bertoletti N, Anderson KS, Bosenberg MW, Jorgensen WL. Newton AS, et al. Among authors: faver jc. ACS Med Chem Lett. 2020 Feb 7;11(5):971-976. doi: 10.1021/acsmedchemlett.0c00011. eCollection 2020 May 14. ACS Med Chem Lett. 2020. PMID: 32435413 Free PMC article.

3

Indoloxytriazines as binding molecules for the JAK2 JH2 pseudokinase domain and its V617F variant.

Newton AS, Liosi ME, Henry SP, Deiana L, Faver JC, Krimmer SG, Puleo DE, Schlessinger J, Jorgensen WL. Newton AS, et al. Among authors: faver jc. Tetrahedron Lett. 2021 Aug 3;77:153248. doi: 10.1016/j.tetlet.2021.153248. Epub 2021 Jul 2. Tetrahedron Lett. 2021. PMID: 34393283 Free PMC article.

4

Pairwise additivity of energy components in protein-ligand binding: the HIV II protease-Indinavir case.

Ucisik MN, Dashti DS, Faver JC, Merz KM Jr. Ucisik MN, et al. Among authors: faver jc. J Chem Phys. 2011 Aug 28;135(8):085101. doi: 10.1063/1.3624750. J Chem Phys. 2011. PMID: 21895219 Free PMC article.

5

Model for the fast estimation of basis set superposition error in biomolecular systems.

Faver JC, Zheng Z, Merz KM Jr. Faver JC, et al. J Chem Phys. 2011 Oct 14;135(14):144110. doi: 10.1063/1.3641894. J Chem Phys. 2011. PMID: 22010701 Free PMC article.

6

The energy computation paradox and ab initio protein folding.

Faver JC, Benson ML, He X, Roberts BP, Wang B, Marshall MS, Sherrill CD, Merz KM Jr. Faver JC, et al. PLoS One. 2011 Apr 25;6(4):e18868. doi: 10.1371/journal.pone.0018868. PLoS One. 2011. PMID: 21541343 Free PMC article.

7

The BioFragment Database (BFDb): An open-data platform for computational chemistry analysis of noncovalent interactions.

Burns LA, Faver JC, Zheng Z, Marshall MS, Smith DGA, Vanommeslaeghe K, MacKerell AD Jr, Merz KM Jr, Sherrill CD. Burns LA, et al. Among authors: faver jc. J Chem Phys. 2017 Oct 28;147(16):161727. doi: 10.1063/1.5001028. J Chem Phys. 2017. PMID: 29096505 Free PMC article.

8

Bringing Clarity to the Prediction of Protein-Ligand Binding Free Energies via "Blurring".

Ucisik MN, Zheng Z, Faver JC, Merz KM. Ucisik MN, et al. Among authors: faver jc. J Chem Theory Comput. 2014 Mar 11;10(3):1314-1325. doi: 10.1021/ct400995c. Epub 2014 Feb 7. J Chem Theory Comput. 2014. PMID: 24803861 Free PMC article.

9

Formal Estimation of Errors in Computed Absolute Interaction Energies of Protein-ligand Complexes.

Faver JC, Benson ML, He X, Roberts BP, Wang B, Marshall MS, Kennedy MR, Sherrill CD, Merz KM Jr. Faver JC, et al. J Chem Theory Comput. 2011 Mar 8;7(3):790-797. doi: 10.1021/ct100563b. J Chem Theory Comput. 2011. PMID: 21666841 Free PMC article.

10

Fragment-based error estimation in biomolecular modeling.

Faver JC, Merz KM Jr. Faver JC, et al. Drug Discov Today. 2014 Jan;19(1):45-50. doi: 10.1016/j.drudis.2013.08.016. Epub 2013 Aug 27. Drug Discov Today. 2014. PMID: 23993915 Free PMC article. Review.

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

26 results

Search Page

Filters