Works matching IS 01928651 AND DT 2001 AND VI 22 AND IP 4
Results: 10
Methods for refining interactively established models of ribosomal RNA towards a physico-chemically plausible structure.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 407, doi. 10.1002/1096-987X(200103)22:4<407::AID-JCC1011>3.0.CO;2-A
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Water structure about the dimer and hexamer repeat units of amylose from molecular dynamics computer simulations.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 445, doi. 10.1002/1096-987X(200103)22:4<445::AID-JCC1015>3.0.CO;2-P
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On the quadratic reaction path evaluated in a reduced potential energy surface model and the problem to locate transition states.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 387, doi. 10.1002/1096-987X(200103)22:4<387::AID-JCC1010>3.0.CO;2-R
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Ab Initio Calculation of structures and properties of halogenated general anesthetics: halothane and sevoflurane.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 436, doi. 10.1002/1096-987X(200103)22:4<436::AID-JCC1014>3.0.CO;2-U
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Adaptive multilevel finite element solution of the Poisson-Boltzmann equation I. Algorithms and examples.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 475, doi. 10.1002/1096-987X(200103)22:4<475::AID-JCC1018>3.0.CO;2-7
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Computations of the Raman optical activity via the sum-over-states expansions.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 426, doi. 10.1002/1096-987X(200103)22:4<426::AID-JCC1013>3.0.CO;2-#
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Numerical Aspects of the Calculation of Second Hyperpolarizabilities Using the Finite Field Method Coupled with a Simple Lanczos Algorithm.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 468, doi. 10.1002/1096-987X(200103)22:4<468::AID-JCC1017>3.0.CO;2-A
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Effect of ligand volume correction on PMF scoring.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 418, doi. 10.1002/1096-987X(200103)22:4<418::AID-JCC1012>3.0.CO;2-3
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Molecular dynamics of minimal B-DNA.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 457, doi. 10.1002/1096-987X(200103)22:4<457::AID-JCC1016>3.0.CO;2-H
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Nonlinear mapping of massive data sets by fuzzy clustering and neural networks.
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- Journal of Computational Chemistry, 2001, v. 22, n. 4, p. 373, doi. 10.1002/1096-987X(200103)22:4<373::AID-JCC1009>3.0.CO;2-8
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