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(2004, November) Journal of Computational Chemistry Vol. 25 (14) Wiley

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Reference TypeJournal (issue)
JournalJournal of Computational Chemistry
Year2004 (November)Volume25
Issue<   14   >
PublisherWiley
Mindat Ref. ID3148144Long-form Identifiermindat:1:5:3148144:3
GUID0
Full Reference(2004, November) Journal of Computational Chemistry Vol. 25 (14) Wiley
Plain Text(2004, November) Journal of Computational Chemistry Vol. 25 (14) Wiley
In(2004) Journal of Computational Chemistry Vol. 25. Wiley

Contains

(2004) Publisher's Note. Journal of Computational Chemistry, 25 (14). doi:10.1002/jcc.20136
(2004) Journal of Computational Chemistry, 25 (14). Wiley. doi:10.1002/jcc.v25:14
Brothers, Edward N., Suarez, Dimas, Deerfield, David W., Merz, Kenneth M. (2004) PM3-compatible zinc parameters optimized for metalloenzyme active sites. Journal of Computational Chemistry, 25 (14). 1677-1692 doi:10.1002/jcc.20086
Shao, Xueguang, Cheng, Longjiu, Cai, Wensheng (2004) A dynamic lattice searching method for fast optimization of Lennard-Jones clusters. Journal of Computational Chemistry, 25 (14). 1693-1698 doi:10.1002/jcc.20096
Wang, Zhi-Xiang, Duan, Yong (2004) Solvation effects on alanine dipeptide: A MP2/cc-pVTZ//MP2/6-31G** study of (?, ?) energy maps and conformers in the gas phase, ether, and water. Journal of Computational Chemistry, 25 (14). 1699-1716 doi:10.1002/jcc.20092
Kenny, Joseph P., Benson, Steven J., Alexeev, Yuri, Sarich, Jason, Janssen, Curtis L., Mcinnes, Lois Curfman, Krishnan, Manojkumar, Nieplocha, Jarek, Jurrus, Elizabeth, Fahlstrom, Carl, Windus, Theresa L. (2004) Component-based integration of chemistry and optimization software. Journal of Computational Chemistry, 25 (14). 1717-1725 doi:10.1002/jcc.20091
Shen, Qi, Jiang, Jian-Hui, Jiao, Chen-Xu, Lin, Wei-Qi, Shen, Guo-Li, Yu, Ru-Qin (2004) Hybridized particle swarm algorithm for adaptive structure training of multilayer feed-forward neural network: QSAR studies of bioactivity of organic compounds. Journal of Computational Chemistry, 25 (14). 1726-1735 doi:10.1002/jcc.20094
Gonçalves, Cristina P., Mohallem, José R. (2004) A new algorithm to handle finite nuclear mass effects in electronic calculations: The ISOTOPE program. Journal of Computational Chemistry, 25 (14). 1736-1739 doi:10.1002/jcc.20093
Lee, Oh-Seuk, Yang, Kiyull, Kang, Keum Duck, Koo, In Sun, Kim, Chan-Kyung, Lee, Ikchoon (2004) Ab initio and DFT studies on hydrolyses of phosphorus halides. Journal of Computational Chemistry, 25 (14). 1740-1748 doi:10.1002/jcc.20104
Ytreberg, F. Marty, Zuckerman, Daniel M. (2004) Efficient use of nonequilibrium measurement to estimate free energy differences for molecular systems. Journal of Computational Chemistry, 25 (14). 1749-1759 doi:10.1002/jcc.20103
Michel, Julien, Taylor, Richard D., Essex, Jonathan W. (2004) The parameterization and validation of generalized born models using the pairwise descreening approximation. Journal of Computational Chemistry, 25 (14). 1760-1770 doi:10.1002/jcc.20105
Masamura, Masao (2004) The effect of basis set superposition error on the convergence of intermolecular interaction energies for deprotonated complexes. Journal of Computational Chemistry, 25 (14). 1771-1778 doi:10.1002/jcc.20106
Szabelski, Pawe?, Talbot, Julian (2004) Kinetics and equilibrium of multicomponent adsorption on chiraly templated surfaces. Journal of Computational Chemistry, 25 (14). 1779-1786 doi:10.1002/jcc.20107
Estrada, Ernesto, Delgado, Eduardo J., Alderete, Joel B., Jaña, Gonzalo A. (2004) Quantum-connectivity descriptors in modeling solubility of environmentally important organic compounds. Journal of Computational Chemistry, 25 (14). 1787-1796 doi:10.1002/jcc.20099
Shah, Premal S., Hom, Geoffrey K., Mayo, Stephen L. (2004) Preprocessing of rotamers for protein design calculations. Journal of Computational Chemistry, 25 (14). 1797-1800 doi:10.1002/jcc.20097
Wagoner, Jason, Baker, Nathan A. (2004) Jason Wagoner and Nathan A. Baker, "Solvation forces on biomolecular structures: A comparison of explicit solvent and Poisson-Boltzmann models,"Journal of Computational Chemistry(2004) 25(13) 1623-1629. Journal of Computational Chemistry, 25 (14). 1801 doi:10.1002/jcc.20108

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