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Journal Articles
- 2012
[j31]María Gálvez-Llompart
, Jorge Gálvez, Ramón García-Domenech, Lemont B. Kier:
Modeling Drug-Induced Anorexia by Molecular Topology. J. Chem. Inf. Model. 52(5): 1337-1344 (2012)- 2003
- [j30]L. Mark Hall, Lowell H. Hall, Lemont B. Kier:
QSAR modeling of beta-lactam binding to human serum proteins. J. Comput. Aided Mol. Des. 17(2-4): 103-118 (2003) - [j29]Lemont B. Kier, Cho-Kung Cheng, Bernard Testa:
Studies of Ligand Diffusion Pathways over a Protein Surface. J. Chem. Inf. Comput. Sci. 43(1): 255-258 (2003) - [j28]L. Mark Hall, Lowell H. Hall, Lemont B. Kier:
Modeling Drug Albumin Binding Affinity with E-State Topological Structure Representation. J. Chem. Inf. Comput. Sci. 43(6): 2120-2128 (2003) - 2002
- [j27]Kimberly Rose, Lowell H. Hall, Lemont B. Kier:
Modeling Blood-Brain Barrier Partitioning Using the Electrotopological State. J. Chem. Inf. Comput. Sci. 42(3): 651-666 (2002) - [j26]Bernard Testa, Lemont B. Kier, Chao-Kun Cheng:
A Cellular Automata Model of Water Structuring by a Chiral Solute. J. Chem. Inf. Comput. Sci. 42(3): 712-716 (2002) - 2001
- [j25]Bernard Testa, Lemont B. Kier, Chun-Kao Cheng, Joachim Mayer:
A Cellular Automata Study of Constraints (Dissolvence) in a Percolating Many-Particle System. Entropy 3(2): 27-57 (2001) - 2000
- [j24]Bernard Testa, Lemont B. Kier:
Emergence and Dissolvence in the Self-organisation of Complex Systems. Entropy 2(1): 1-25 (2000) - [j23]Lowell H. Hall, Lemont B. Kier:
The E-State as the Basis for Molecular Structure Space Definition and Structure Similarity. J. Chem. Inf. Comput. Sci. 40(3): 784-791 (2000) - [j22]Lemont B. Kier, Lowell H. Hall:
Intermolecular Accessibility: The Meaning of Molecular Connectivity. J. Chem. Inf. Comput. Sci. 40(3): 792-795 (2000) - [j21]Lemont B. Kier:
A Cellular Automata Model of Bond Interactions Among Molecules. J. Chem. Inf. Comput. Sci. 40(5): 1285-1288 (2000) - 1999
- [j20]Lemont B. Kier, Chao-Kun Cheng, Bernard Testa:
Cellular automata models of biochemical phenomena. Future Gener. Comput. Syst. 16(2-3): 273-289 (1999) - [j19]Lemont B. Kier, Chao-Kun Cheng, Bernard Testa:
A Cellular Automata Model of the Percolation Process. J. Chem. Inf. Comput. Sci. 39(2): 326-332 (1999) - 1998
- [j18]Lemont B. Kier, Chao-Kun Cheng, Michael Tute, Paul G. Seybold:
A Cellular Automata Model of Acid Dissociation. J. Chem. Inf. Comput. Sci. 38(2): 271-275 (1998) - 1997
- [j17]Paul G. Seybold, Lemont B. Kier, Chao-Kung Cheng:
Simulation of First-Order Chemical Kinetics Using Cellular Automata. J. Chem. Inf. Comput. Sci. 37(2): 386-391 (1997) - [j16]Lemont B. Kier, Lowell H. Hall:
The E-State as an Extended Free Valence. J. Chem. Inf. Comput. Sci. 37(3): 548-552 (1997) - 1996
- [j15]Bernard Testa, Lemont B. Kier:
Complex systems in drug research: I. The chemical levels. Complex. 1(4): 29-36 (1996) - [j14]Lemont B. Kier, Bernard Testa:
Complex systems in drug research: II. The ligand - active site - water confluence as a complex system. Complex. 1(4): 37-42 (1996) - [j13]Glen Eugene Kellogg, Lemont B. Kier, Patrick Gaillard, Lowell H. Hall:
E-state fields: Applications to 3D QSAR. J. Comput. Aided Mol. Des. 10(6): 513-520 (1996) - 1995
- [j12]Lowell H. Hall, Lemont B. Kier:
Electrotopological State Indices for Atom Types: A Novel Combination of Electronic, Topological, and Valence State Information. J. Chem. Inf. Comput. Sci. 35(6): 1039-1045 (1995) - [j11]Chao-Kung Cheng, Lemont B. Kier:
A Cellular Automata Model of Oil-Water Partitioning. J. Chem. Inf. Comput. Sci. 35(6): 1054-1059 (1995) - [j10]Lowell H. Hall, Lemont B. Kier, Briscoe B. Brown:
Molecular Similarity Based on Novel Atom-Type Electrotopological State Indices. J. Chem. Inf. Comput. Sci. 35(6): 1074-1080 (1995) - 1994
- [j9]Lemont B. Kier, Chao-Kun Cheng:
A Cellular Automata Model of Water. J. Chem. Inf. Comput. Sci. 34(3): 647-652 (1994) - [j8]Lemont B. Kier, Chao-Kun Cheng:
A Cellular Automata Model of an Aqueous Solution. J. Chem. Inf. Comput. Sci. 34(6): 1334-1337 (1994) - 1993
- [j7]Lemont B. Kier, Lowell H. Hall, Jack W. Frazer:
Design of molecules from quantitative structure-activity relationship models. 1. Information transfer between path and vertex degree counts. J. Chem. Inf. Comput. Sci. 33(1): 143-147 (1993) - [j6]Lowell H. Hall, Lemont B. Kier, Jack W. Frazer:
Design of molecules from quantitative structure-activity relationship models. 2. Derivation and proof of information transfer relating equations. J. Chem. Inf. Comput. Sci. 33(1): 148-152 (1993) - [j5]Lowell H. Hall, Robert S. Dailey, Lemont B. Kier:
Design of molecules from quantitative structure-activity relationship models. 3. Role of higher order path counts: Path 3. J. Chem. Inf. Comput. Sci. 33(4): 598-603 (1993) - 1992
- [j4]Alexandru T. Balaban, Nikhil Joshi, Lemont B. Kier, Lowell H. Hall:
Correlations between chemical structure and normal boiling points of halogenated alkanes C1-C4. J. Chem. Inf. Comput. Sci. 32(3): 233-237 (1992) - [j3]Alexandru T. Balaban, Lemont B. Kier, Nikhil Joshi:
Correlations between chemical structure and normal boiling points of acyclic ethers, peroxides, acetals, and their sulfur analogs. J. Chem. Inf. Comput. Sci. 32(3): 237-244 (1992) - 1991
- [j2]Lowell H. Hall, Brian Mohney, Lemont B. Kier:
The electrotopological state: structure information at the atomic level for molecular graphs. J. Chem. Inf. Comput. Sci. 31(1): 76-82 (1991) - 1980
- [j1]Margaret A. Mosby, Lemont B. Kier:
Method for Generating a Chemical Reaction Index for Storage and Retrieval of Information. J. Chem. Inf. Comput. Sci. 20(4): 217-221 (1980)
Conference and Workshop Papers
- 2009
- [c1]Nathan B. Menke, Kevin R. Ward, Lemont B. Kier, Chao-Kun Cheng, Umesh R. Desai:
A Computational Analysis of the Synergistic Effect of Coagulation Inhibitors on the Generation of Thrombin. AAAI Fall Symposium: Complex Adaptive Systems and the Threshold Effect 2009
Reference Works
- 2009
- [r1]Lemont B. Kier, Paul G. Seybold:
Cellular Automata Modeling of Complex Biochemical Systems. Encyclopedia of Complexity and Systems Science 2009: 848-865
Coauthor Index
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