American Chemical Society (ACS)

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Selected Concepts and Investigations in Compound Classification, Molecular Descriptor Analysis, and Virtual Screening
American Chemical Society (ACS) - Tập 41 Số 2 - Trang 233-245 - 2001
Jürgen Bajorath
Electrotopological State Indices for Atom Types: A Novel Combination of Electronic, Topological, and Valence State Information
American Chemical Society (ACS) - Tập 35 Số 6 - Trang 1039-1045 - 1995
Lowell H. Hall, Lemont B. Kier
Infrared Spectra Information and Their Correlation with QSAR Descriptors
American Chemical Society (ACS) - Tập 39 Số 3 - Trang 558-562 - 1999
Romualdo Benigni, Laura Passerini, David J. Livingstone, Mark A. Johnson, Alessandro Giuliani
The Signature Molecular Descriptor. 4. Canonizing Molecules Using Extended Valence Sequences
American Chemical Society (ACS) - Tập 44 Số 2 - Trang 427-436 - 2004
Jean‐Loup Faulon, Michael J. Collins, Robert D. Carr
The Coding of the Three-Dimensional Structure of Molecules by Molecular Transforms and Its Application to Structure-Spectra Correlations and Studies of Biological Activity
American Chemical Society (ACS) - Tập 36 Số 2 - Trang 334-344 - 1996
Jan Schuur, Paul M. Selzer, Johann Gasteiger
The Signature Molecular Descriptor. 1. Using Extended Valence Sequences in QSAR and QSPR Studies
American Chemical Society (ACS) - Tập 43 Số 3 - Trang 707-720 - 2003
Jean‐Loup Faulon, Donald P. Visco, Ramdas S. Pophale
Novel Variable Selection Quantitative Structure−Property Relationship Approach Based on thek-Nearest-Neighbor Principle
American Chemical Society (ACS) - Tập 40 Số 1 - Trang 185-194 - 2000
Weifan Zheng, Alexander Tropsha
SwaN-NMR: A Complete and Expansible NMR Software for the Macintosh
American Chemical Society (ACS) - Tập 34 Số 6 - Trang 1235-1241 - 1994
Giuseppe Balacco
Efficient exact solution of the ring perception problem
American Chemical Society (ACS) - Tập 34 Số 4 - Trang 822-831 - 1994
Renzo Balducci, Robert S. Pearlman
Wavelet Neural Network and Its Application to the Inclusion of β-Cyclodextrin with Benzene Derivatives
American Chemical Society (ACS) - Tập 39 Số 1 - Trang 133-138 - 1999
Lei Liu, Qing‐Xiang Guo
Tổng số: 54   
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