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Computer-Chemie-Centrum
Friedrich-Alexander-Universität Erlangen-Nürnberg
Naturwissenschaftliche Fakultät
Department Chemie und Pharmazie
Overview
Publications
(674)
Research Grants
(6)
Types of publications
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Journal article
Journal article
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Book chapter / Article in edited volumes
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Authored book
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Translation
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Thesis
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Conference contribution
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Unpublished / Preprint
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Filters (inactive)
beta-lactamase, a semiempirical study and novel mechanism. (2001)
King W, Clark T
Other publication type
A quantum mechanical/neural net model for boiling points with error estimation (2001)
Beck B, Clark T
Journal article
Theoretical investigation into structures and magnetic properties of smaller fullerenes and their heteroanalogues (2001)
Chen Z, Jiao H, Bühl M, Hirsch A, Thiel W
Journal article, Original article
The 2(N+1)2 rule for spherical aromaticity: Further validation (2001)
Chen Z, Jiao H, Hirsch A, Thiel W
Journal article, Original article
Spherical aromaticity of inorganic cage molecules (2001)
Hirsch A, Chen Z, Jiao H
Journal article, Original article
Ground-state tautomerism and rotational isomerization in 4,5-dimethyl-2-(2-hydroxyphenyl)imidazole in the gas phase and in polar solvents: a theoretical study of the aromaticity, intramolecular hydrogen-bond strength and differential solute-solvent interactions (2001)
Clark T
Journal article
Rational Molecular Design and EPC Synthesis of a Type VI ß-Turn Inducing Peptide Mimetic (2001)
Hoffmann T, Lanig H, Waibel R, Gmeiner P
Journal article, Original article
Quantum cheminformatics: An oxymoron? Part II (2001)
Clark T
Conference contribution
BN-doped fullerenes: An NICS characterization (2001)
Chen Z, Jiao H, Hirsch A, Thiel W
Journal article, Original article
Quo Vadis semiempirical MO-theory? (2000)
Clark T
Journal article
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