Charge and bond order-based similarity analysis of pi-conjugated organic

molecules

Valentin Monev

Institute of Organic Chemistry with Center of PhytochemistryBulgarian Academy of Sciences

introduction

2

introduction

3

4

we introduce the similarity concept into quantum chemistry

5Fratev, F., O. E. Polansky, A. Mehlhorn and V. Monev (1979). Application of distance and similarity measures - comparison of

molecular electronic structures in arbitrary electronic states. J. Mol. Struct. 56(2): 245-253

we introduce the similarity concept into quantum chemistry

6Fratev, F., O. E. Polansky, A. Mehlhorn and V. Monev (1979). Application of distance and similarity measures - comparison of

molecular electronic structures in arbitrary electronic states. J. Mol. Struct. 56(2): 245-253

we introduce the similarity concept into quantum chemistry

7Fratev, F., O. E. Polansky, A. Mehlhorn and V. Monev (1979). Application of distance and similarity measures - comparison of

molecular electronic structures in arbitrary electronic states. J. Mol. Struct. 56(2): 245-253

we introduce the similarity concept into quantum chemistry

8Fratev, F., O. E. Polansky, A. Mehlhorn and V. Monev (1979). Application of distance and similarity measures - comparison of

molecular electronic structures in arbitrary electronic states. J. Mol. Struct. 56(2): 245-253

possible applications of charge and bond order-based similarity analysis

9Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

10Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

11Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

12Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

13Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

14Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

15Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

16Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

17Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

18Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

19Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

20Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

possible applications of charge and bond order-based similarity analysis

21Neykov, G., V. Enchev, V. Monev and I. Kanev (1995). Electronic structure and polarizabilities of some heterocycles. I.

Hydroxypyrazoles amd related molecules. Molecular Engineering 5: 347-361

appendix

22Mehlhorn, A., F. Fratev, O. E. Polansky and V. Monev (1984). Distance measures. A new tool for the analysis and characterization of

molecular properties. MATCH-Commun. Math. Comput. Chem.(15): 3-107

we develop the conceptual apparatus of similarity

23Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

24Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

25Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

26Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

27Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

28Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

29Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

30Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

we develop the conceptual apparatus of similarity

31Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

32Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

33Monev, V. (2004). Introduction to similarity searching in chemistry. MATCH-Commun. Math. Comput. Chem.(51): 7-38

34

standing on the shoulders of giants

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