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Irwin D. Tack Kuntz, Ph.D.

Affiliations: 
1965-1971 Chemistry Princeton University, Princeton, NJ 
 1971-2003 Pharmaceutical Chemistry University of California, San Francisco, San Francisco, CA 
Area:
determination of protein structure in solution, fast folding processes in proteins, and structure based molecular design
Website:
http://dock.compbio.ucsf.edu/Group/group.html
Google:
"Irwin D. Kuntz"
Bio:

http://mdi.ucsf.edu/aboutIDK_2.html
http://mdi.ucsf.edu/KuntzBio.html

Mean distance: 8.09
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Parents

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Melvin Calvin grad student 1965 UC Berkeley
 (Spectroscopic studies of photosynthesis)

Children

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Francis P Gasparro grad student 1971 Princeton
Patricia C. Babbitt grad student 1988 UCSF
Valerie D. Daggett grad student 1990 UCSF
Brian K. Shoichet grad student 1991 UCSF
David Clifford Sullivan grad student 2001 UCSF
Jose Teodorico Haresco grad student 2002 UCSF
Natasja Brooijmans grad student 2003 UCSF
Tiba Aynechi grad student 2004 UCSF
Kevin M. Masukawa grad student 2004 UCSF
Felice Lu grad student 2005 UCSF
Anang A. Shelat grad student 2005 UCSF
P. T. Lang grad student 2006 UCSF
Gordon M. Crippen post-doc UCSF
Pradipta Bandyopadhyay post-doc 2001-2002 UCSF

Collaborators

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BETA: Related publications

Publications

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Allen WJ, Balius TE, Mukherjee S, et al. (2015) DOCK 6: Impact of new features and current docking performance. Journal of Computational Chemistry. 36: 1132-56
Lang PT, Brozell SR, Mukherjee S, et al. (2009) DOCK 6: combining techniques to model RNA-small molecule complexes. Rna (New York, N.Y.). 15: 1219-30
Bandyopadhyay P, Kuntz ID. (2009) Computational investigation of kinetics of cross-linking reactions in proteins: importance in structure prediction. Biopolymers. 91: 68-77
Guo X, Bandyopadhyay P, Schilling B, et al. (2008) Partial acetylation of lysine residues improves intraprotein cross-linking. Analytical Chemistry. 80: 951-60
Fujii N, Haresco JJ, Novak KA, et al. (2007) Rational design of a nonpeptide general chemical scaffold for reversible inhibition of PDZ domain interactions. Bioorganic & Medicinal Chemistry Letters. 17: 549-52
Rizzo RC, Aynechi T, Case DA, et al. (2006) Estimation of Absolute Free Energies of Hydration Using Continuum Methods:  Accuracy of Partial Charge Models and Optimization of Nonpolar Contributions. Journal of Chemical Theory and Computation. 2: 128-39
Moustakas DT, Lang PT, Pegg S, et al. (2006) Development and validation of a modular, extensible docking program: DOCK 5. Journal of Computer-Aided Molecular Design. 20: 601-19
Lu F, Chi SW, Kim DH, et al. (2006) Proteomimetic libraries: design, synthesis, and evaluation of p53-MDM2 interaction inhibitors. Journal of Combinatorial Chemistry. 8: 315-25
Rizzo RC, Aynechi T, Case DA, et al. (2006) Estimation of absolute free energies of hydration using continuum methods: Accuracy of partial charge models and optimization of nonpolar contributions Journal of Chemical Theory and Computation. 2: 128-139
Therese Lang P, Aynechi T, Moustakas D, et al. (2006) Molecular Docking and Structure-Based Design Drug Discovery Research: New Frontiers in the Post-Genomic Era. 1-23
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