Modeling a Crowdsourced Definition of Molecular Complexity-Reference-Cited by-同舟云学术

Modeling a Crowdsourced Definition of Molecular Complexity

Published:2014-05-20 Issue:6 Volume:54 Page:1604-1616
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Sheridan Robert P.¹,Zorn Nicolas²,Sherer Edward C.¹,Campeau Louis-Charles³,Chang Charlie (Zhenyu)⁴,Cumming Jared⁵,Maddess Matthew L.⁶,Nantermet Philippe G.⁷,Sinz Christopher J.⁸,O’Shea Paul D.⁹

Affiliation:

1. Structural Chemistry, Merck Research Laboratories, Merck & Co., Inc., P.O. Box 2000, Rahway, New Jersey 07065, United States

2. Structural Chemistry, Merck Research Laboratories, Merck & Co., Inc., 2000 Galloping Hill Road, Kenilworth, New Jersey 07033, United States

3. Process Chemistry, Merck Research Laboratories, Merck & Co., Inc., P.O. Box 2000, Rahway, New Jersey 07065, United States

4. Structural Chemistry, Merck Research Laboratories, Merck & Co., Inc., 33 Avenue Louis Pasteur, Boston, Massachusetts 02115, United States

5. Discovery Chemistry, Merck Research Laboratories, Merck & Co., Inc., 2000 Galloping Hill Road, Kenilworth, New Jersey 07033, United States

6. Process Chemistry, Merck Research Laboratories, Merck & Co., Inc., 33 Avenue Louis Pasteur, Boston, Massachusetts 02115, United States

7. Discovery Chemistry, Merck Research Laboratories, Merck & Co., Inc., 770 Sumneytown Pike, West Point, Pennsylvania 19486, United States

8. Discovery Chemistry, Merck Research Laboratories, Merck & Co., Inc., P.O. Box 2000, Rahway, New Jersey 07065, United States

9. Analytical Chemistry, Merck Research Laboratories, Merck & Co., Inc., P.O. Box 2000, Rahway, New Jersey 07065, United States

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci5001778

Reference34 articles.

1. The first general index of molecular complexity

2. Molecular complexity: a simplified formula adapted to individual atoms

3. On the Structure of Total Synthesis of Complex Natural Products

4. A New and Simple Approach to Chemical Complexity. Application to the Synthesis of Natural Products

5. Complexity of synthetic reactions. The use of complexity indices to evaluate reactions, transforms and disconnections1Electronic supplementary information (ESI) available: a Prolegomenon to chemical graph theory; Table 13 and Figure 1, summarizing all possible disconnections of azacyclohexane 28. See http://www.rsc.org/suppdata/nj/b2/b210843g/

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