-
1
-
-
0030635856
-
A QSAR study of the antimalarial activity of some synthetic 1,2,4-trioxanes
-
M. Grigorov, J. Weber, J. M. J. Tronchet, C. Jefford, W. K. Milhous and D. Maric, A QSAR study of the antimalarial activity of some synthetic 1,2,4-trioxanes, J. Chem. Inf. Comput. Sci. 1997, 37, 124-130.
-
(1997)
J. Chem. Inf. Comput. Sci
, vol.37
, pp. 124-130
-
-
Grigorov, M.1
Weber, J.2
Tronchet, J.M.J.3
Jefford, C.4
Milhous, W.K.5
Maric, D.6
-
2
-
-
0027725172
-
Structure-relationships of the antimalarial agent artemisinin. 1. Synthesis and comparative molecular-field analysis of C-9 analogs of artemisinin and 10-deoxoartemisinin
-
M. A. Avery, F. Gao, W. K. M. Chong, S. Methrotra and W. K. Milhous, Structure-relationships of the antimalarial agent artemisinin. 1. Synthesis and comparative molecular-field analysis of C-9 analogs of artemisinin and 10-deoxoartemisinin, J. Med. Chem. 1993, 36, 4264-4275.
-
(1993)
J. Med. Chem
, vol.36
, pp. 4264-4275
-
-
Avery, M.A.1
Gao, F.2
Chong, W.K.M.3
Methrotra, S.4
Milhous, W.K.5
-
3
-
-
0029845745
-
Structure-activity relationships of the antimalarial agent artemisinin. 5. Analogs of 10-deoxoartemisinin substituted at C-3 and C-9
-
M. A. Avery, S. Methrotra, T. L. Johnson, J. D. Brak, J. A. Vroman and R. Miller, Structure-activity relationships of the antimalarial agent artemisinin. 5. Analogs of 10-deoxoartemisinin substituted at C-3 and C-9, J. Med. Chem. 1996, 39, 4149-4155.
-
(1996)
J. Med. Chem
, vol.39
, pp. 4149-4155
-
-
Avery, M.A.1
Methrotra, S.2
Johnson, T.L.3
Brak, J.D.4
Vroman, J.A.5
Miller, R.6
-
4
-
-
0031055744
-
Synthesis, antimalarial activity, and molecular modeling of tebuqine analogues
-
P. M. O'Neill, D. J. Willock, S. R. Hawley, P. G. Bray, R. C. Storr, S. A. Ward and B. K. Park, Synthesis, antimalarial activity, and molecular modeling of tebuqine analogues, J. Med. Chem. 1997, 40, 437-348.
-
(1997)
J. Med. Chem
, vol.40
, pp. 437-348
-
-
O'Neill, P.M.1
Willock, D.J.2
Hawley, S.R.3
Bray, P.G.4
Storr, R.C.5
Ward, S.A.6
Park, B.K.7
-
5
-
-
0032481004
-
Structure-activity relationship for antiplasmodial activity among 7-substuted 4-aminoquinolines
-
D. Y. D. De, F. M. Krogs tad, L. D. Byers, Structure-activity relationship for antiplasmodial activity among 7-substuted 4-aminoquinolines, J. Med. Chem. 1998, 41, 4918-4926.
-
(1998)
J. Med. Chem
, vol.41
, pp. 4918-4926
-
-
De, D.Y.D.1
Krogs tad, F.M.2
Byers, L.D.3
-
6
-
-
0033619978
-
-
P. M. O'Neill, N. L. Searle, K.-W. Kan, R. C. Storr, J. L. Maggs, S. A. Ward, K. Raynes and B. K. Park, J. Med. Chem. 1999, 42, 5487-5493.
-
(1999)
J. Med. Chem
, vol.42
, pp. 5487-5493
-
-
O'Neill, P.M.1
Searle, N.L.2
Kan, K.-W.3
Storr, R.C.4
Maggs, J.L.5
Ward, S.A.6
Raynes, K.7
Park, B.K.8
-
7
-
-
21844497812
-
Quantum Chemistry and drug design
-
H. U. Suter, D. M. Maric, J. Weber, C. Thomson, Quantum Chemistry and drug design, Chimia 1995, 49, 125-127.
-
(1995)
Chimia
, vol.49
, pp. 125-127
-
-
Suter, H.U.1
Maric, D.M.2
Weber, J.3
Thomson, C.4
-
8
-
-
84987080978
-
Computational studies of the structures and properties of potential antimalarial compounds based on the 1,2,4-trioxane ring structure. 1. Artemisinin-like molecules
-
G. Bernardinelli, C. W. Jefford, D. Maric, C. Thomson, J. Weber, Computational studies of the structures and properties of potential antimalarial compounds based on the 1,2,4-trioxane ring structure. 1. Artemisinin-like molecules, Int. J. Quant. Chem.: Biol. Symp. Suppl. 1994, 21, 117-131.
-
(1994)
Int. J. Quant. Chem.: Biol. Symp. Suppl
, vol.21
, pp. 117-131
-
-
Bernardinelli, G.1
Jefford, C.W.2
Maric, D.3
Thomson, C.4
Weber, J.5
-
9
-
-
0029850335
-
Molecular electronic properties of a series of 4-quinolinecarbinolamine define antimalarial activity profile
-
A. K. Bhattacharjee and J. M. Karle, Molecular electronic properties of a series of 4-quinolinecarbinolamine define antimalarial activity profile, J. Med. Chem. 1996, 39, 4622-4629.
-
(1996)
J. Med. Chem
, vol.39
, pp. 4622-4629
-
-
Bhattacharjee, A.K.1
Karle, J.M.2
-
10
-
-
84996031852
-
Analysis of structure activity for primaquine antimalarial-drugs by quantum pharmacological approach
-
S. Kokpol, S. V. Hannongbua, N. Thongrit, S, Polman, B. M. Rode and M. G. Schwendinger, Analysis of structure activity for primaquine antimalarial-drugs by quantum pharmacological approach, Anal. Sci. 1988, 4, 565-568.
-
(1988)
Anal. Sci
, vol.4
, pp. 565-568
-
-
Kokpol, S.1
Hannongbua, S.V.2
Thongrit, N.3
Polman, S.4
Rode, B.M.5
Schwendinger, M.G.6
-
11
-
-
84996039297
-
Quantum pharmacological analysis of structure activity relationship for mefloquine antimalarial-drugs
-
S, Polman, S. Kokpol, S. V. Hannongbua and M. Rode, Quantum pharmacological analysis of structure activity relationship for mefloquine antimalarial-drugs, Anal. Sci, 1989, 5, 641-644.
-
(1989)
Anal. Sci
, vol.5
, pp. 641-644
-
-
Polman, S.1
Kokpol, S.2
Hannongbua, S.V.3
Rode, M.4
-
12
-
-
0029690742
-
Quantum pharmacological analysis of structure-activity relationships for mefloquine antimalarial drugs using optimal transformations
-
V. Nguyen and B. M. Rode, Quantum pharmacological analysis of structure-activity relationships for mefloquine antimalarial drugs using optimal transformations, J. Chem. Inf. Comput. Sci. 1996, 36, 114-117.
-
(1996)
J. Chem. Inf. Comput. Sci
, vol.36
, pp. 114-117
-
-
Nguyen, V.1
Rode, B.M.2
-
13
-
-
0035903890
-
Antimalarial activity of dihydroartemisinin derivatives against P. falciparum: A quantum chemical and multivariate study
-
J. C. Pinheiro, M. M. C. Ferreira and O. A. R. Sanchez, Antimalarial activity of dihydroartemisinin derivatives against P. falciparum: a quantum chemical and multivariate study, J. Mol. Struct.(Theochem) 2001, 36, 35-44.
-
(2001)
J. Mol. Struct.(Theochem)
, vol.36
, pp. 35-44
-
-
Pinheiro, J.C.1
Ferreira, M.M.C.2
Sanchez, O.A.R.3
-
14
-
-
0036315633
-
-
F. Cheng, J. Shen, X. Luo, W. Zhu, J. Gu, R. Ji, H. Jiang and K. Chen, Bioorg. & Med. Chem. 2002, 10, 2883-2891.
-
(2002)
Bioorg. & Med. Chem
, vol.10
, pp. 2883-2891
-
-
Cheng, F.1
Shen, J.2
Luo, X.3
Zhu, W.4
Gu, J.5
Ji, R.6
Jiang, H.7
Chen, K.8
-
15
-
-
0347419176
-
Artemisinin Derivatives with Antimalarial Activity against Plasmodium falciparum Designed with the Aid of Quantum Chemical and Partial Least Squares Methods
-
J. C. Pinheiro, R. Kiralj, M. M. C. Ferreira and O. A. S. Romero, Artemisinin Derivatives with Antimalarial Activity against Plasmodium falciparum Designed with the Aid of Quantum Chemical and Partial Least Squares Methods, QSAR Comb. Sci. 2003, 22, 830-842.
-
(2003)
QSAR Comb. Sci
, vol.22
, pp. 830-842
-
-
Pinheiro, J.C.1
Kiralj, R.2
Ferreira, M.M.C.3
Romero, O.A.S.4
-
16
-
-
0002126202
-
The nonenzymatic dimerization of 5-aminolevulinic acid
-
A. R. Butler and Y.-L. Wu, The nonenzymatic dimerization of 5-aminolevulinic acid, Chem. Soc. Rev. 1992, 21, 85-90.
-
(1992)
Chem. Soc. Rev
, vol.21
, pp. 85-90
-
-
Butler, A.R.1
Wu, Y.-L.2
-
17
-
-
0021948029
-
Qinghaosu (Artemisinin): An antimalarial drug from China
-
D. L. Klayman, Qinghaosu (Artemisinin): An antimalarial drug from China, Science 1985, 228, 1049-1055.
-
(1985)
Science
, vol.228
, pp. 1049-1055
-
-
Klayman, D.L.1
-
18
-
-
0033554788
-
Current Status of Artemisinin and its Derivatives as Antimalarial Drugs
-
V. Dhingra, K. V. Rao and L. Narasu, Current Status of Artemisinin and its Derivatives as Antimalarial Drugs, Life Sciences 2000, 66, 279-300.
-
(2000)
Life Sciences
, vol.66
, pp. 279-300
-
-
Dhingra, V.1
Rao, K.V.2
Narasu, L.3
-
19
-
-
0030910898
-
Identification of Hemoglobin Degradation Products in Plasmodium falciparum
-
S Kamchonwongpaisan, E. Samoff and S. R. Meschinck, Identification of Hemoglobin Degradation Products in Plasmodium falciparum, Mol. Biochem. Parasitl. 1997, 86, 179-186.
-
(1997)
Mol. Biochem. Parasitl
, vol.86
, pp. 179-186
-
-
Kamchonwongpaisan, S.1
Samoff, E.2
Meschinck, S.R.3
-
20
-
-
0035906935
-
Characterization of the Alkylation Product of Heme by the Antimalarial Drug Artemisinin
-
Chem. Int. Ed, 2001
-
A. Robert, J. Cazelles and B. Meunier, Characterization of the Alkylation Product of Heme by the Antimalarial Drug Artemisinin, Angwe. Chem. Int. Ed. 2001, 40, 1954-1957.
-
(1954)
Angwe
, vol.40
-
-
Robert, A.1
Cazelles, J.2
Meunier, B.3
-
21
-
-
0028120927
-
The Interaction of Artemisinin with Malarial Hemozoin
-
Y. L. Hon, Y. Z. Yang and S. R. Meschnick, The Interaction of Artemisinin with Malarial Hemozoin, Mol. Biochem. Parasitol. 1998, 63, 121-128.
-
(1998)
Mol. Biochem. Parasitol
, vol.63
, pp. 121-128
-
-
Hon, Y.L.1
Yang, Y.Z.2
Meschnick, S.R.3
-
22
-
-
0034700205
-
A possible antimalarial action mode of qinghaosu (artemisinin) series compounds. .Alkylation of reduced glutathione by C-centered primary radicals produced from antimalarial compound qinghaosu and 12-(2, 4-imethoxyphenyl)-12-deoxoqinghaosu
-
D. Y. Wang and Y. L. Wu, A possible antimalarial action mode of qinghaosu (artemisinin) series compounds. .Alkylation of reduced glutathione by C-centered primary radicals produced from antimalarial compound qinghaosu and 12-(2, 4-imethoxyphenyl)-12-deoxoqinghaosu, Chem. Commun. 2000, 22, 2193-2194.
-
(2000)
Chem. Commun
, vol.22
, pp. 2193-2194
-
-
Wang, D.Y.1
Wu, Y.L.2
-
23
-
-
2942666622
-
Highly Antimalaria-Active Artemisinin Derivatives: Biological Activity Does Not Correlate with Chemical Reactivity
-
R. K. Hynes, W.-Y. Ho, H.-W. Chen, B. Fugmann, J. Stetter, S. L. Croft, L. Vivas, W. Peters and B. R. Robinson, Highly Antimalaria-Active Artemisinin Derivatives: Biological Activity Does Not Correlate with Chemical Reactivity, Angew. Chem. Int. Ed. 2004, 43, 1381-1385.
-
(2004)
Angew. Chem. Int. Ed
, vol.43
, pp. 1381-1385
-
-
Hynes, R.K.1
Ho, W.-Y.2
Chen, H.-W.3
Fugmann, B.4
Stetter, J.5
Croft, S.L.6
Vivas, L.7
Peters, W.8
Robinson, B.R.9
-
24
-
-
17044427198
-
Reply o Comments on Highly Antimalarial-Active Artemisinin Derivatives: Biological Activity Does Not Correlate with Chemical Reactivity
-
44
-
H. K. Rynes, Reply o Comments on "Highly Antimalarial-Active Artemisinin Derivatives: Biological Activity Does Not Correlate with Chemical Reactivity", Angew. Chem. Int. Ed. 2005, 44, 2064-2065.
-
(2005)
Angew. Chem. Int. Ed
, pp. 2064-2065
-
-
Rynes, H.K.1
-
25
-
-
2342430094
-
New Development Molecular Orbital Theory
-
C. C. J. Roothaan, New Development Molecular Orbital Theory, Rev. Mod. Phys. 1951, 23, 69-68.
-
(1951)
Rev. Mod. Phys
, vol.23
, pp. 69-68
-
-
Roothaan, C.C.J.1
-
26
-
-
2442617487
-
Self-Consistent Molecular Orbital Methods.21. Small Split-Valence Basis Sets for Row Elements
-
J. S. Binkley, J. A. Pople and W. J. Hehre, Self-Consistent Molecular Orbital Methods.21. Small Split-Valence Basis Sets for Row Elements, J. Am. Chem. Soc. 1980, 102, 939-946.
-
(1980)
J. Am. Chem. Soc
, vol.102
, pp. 939-946
-
-
Binkley, J.S.1
Pople, J.A.2
Hehre, W.J.3
-
27
-
-
0004219193
-
Chemometrics
-
Wiley & Sons, N. Y
-
K. R. Beebe, R. J. Pell, M. B. Seasholtz, Chemometrics: A Pratical Guide, Wiley & Sons, N. Y., 1998.
-
(1998)
A Pratical Guide
-
-
Beebe, K.R.1
Pell, R.J.2
Seasholtz, M.B.3
-
29
-
-
34848887653
-
-
GaussView 1.0, Gaussian Inc.: Pittsburg, PA, 1997.
-
GaussView 1.0, Gaussian Inc.: Pittsburg, PA, 1997.
-
-
-
-
30
-
-
0023877081
-
Crystal and molecular structure of Qinghaosu: A redetermination
-
I. Leban, L. Golic, M. Japelj, Crystal and molecular structure of Qinghaosu: a redetermination, Acta Pharm. Jusgosl. 1988, 38, 71-77.
-
(1988)
Acta Pharm. Jusgosl
, vol.38
, pp. 71-77
-
-
Leban, I.1
Golic, L.2
Japelj, M.3
-
31
-
-
0001752768
-
The Cambridge Structural Database: A quarter of a million crystal structures rising
-
F. H. Allen, The Cambridge Structural Database: a quarter of a million crystal structures rising, Acta Cryst. 2002, B58, 380-388.
-
(2002)
Acta Cryst
, vol.B58
, pp. 380-388
-
-
Allen, F.H.1
-
32
-
-
34848896835
-
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Millam, A. D. Daniels, K. N. Kudin, M. C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G. A. Petersson, P. Y. Ayala, Q. Cui, K. Morokuma, P. Salvador, J. J. Dannenberg, D. K. Malick, A. D. Rabuck, K. Raghavachari, J. B. Foresman, J. Cioslowski, J. V. Ortiz, A. G. Baboul, B. B. Sefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R. L. Martin, D. J. Fox, T. Keith, M. A. A-Laham, C. Y. Peng, A. Nanayakkara, M. Challacombe, P. M. W. Gill, B. Johnson, W. Chen, M. W. Wong, J. L. Andes, C. Gonzalez, M. Head-Gordon, E. S. Replogle, J. A. Pople, Gaussian 98 - Revision A.11, Gaussian, Inc., Pittsburgh, PA, 2001.
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Millam, A. D. Daniels, K. N. Kudin, M. C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G. A. Petersson, P. Y. Ayala, Q. Cui, K. Morokuma, P. Salvador, J. J. Dannenberg, D. K. Malick, A. D. Rabuck, K. Raghavachari, J. B. Foresman, J. Cioslowski, J. V. Ortiz, A. G. Baboul, B. B. Sefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R. L. Martin, D. J. Fox, T. Keith, M. A. A-Laham, C. Y. Peng, A. Nanayakkara, M. Challacombe, P. M. W. Gill, B. Johnson, W. Chen, M. W. Wong, J. L. Andes, C. Gonzalez, M. Head-Gordon, E. S. Replogle, J. A. Pople, Gaussian 98 - Revision A.11, Gaussian, Inc., Pittsburgh, PA, 2001.
-
-
-
-
33
-
-
84986513567
-
Determining atom-centered monopoles from molecular electrostatic potential - the need for high sampling density in formamide conformational-analysis
-
C. M. Breneman, K. B. Wiberg, Determining atom-centered monopoles from molecular electrostatic potential - the need for high sampling density in formamide conformational-analysis, J. Comp. Chem. 1990, 11, 361-373.
-
(1990)
J. Comp. Chem
, vol.11
, pp. 361-373
-
-
Breneman, C.M.1
Wiberg, K.B.2
-
34
-
-
34848885080
-
-
ChemPlus: Modular Extensions to HyperChem Release 6.02, Molecular Modeling for Windows, HyperClub, Inc, Gainesville, 2000
-
ChemPlus: Modular Extensions to HyperChem Release 6.02, Molecular Modeling for Windows, HyperClub, Inc., Gainesville, 2000.
-
-
-
-
36
-
-
0003145118
-
Molecular Concepts: Representations of Molecules
-
H. van de Waterbeemd Ed, VCH, N. Y
-
P. C. Jurs, S. L. Dixon, L. M. Egolf, Molecular Concepts: Representations of Molecules, in: H. van de Waterbeemd (Ed.), Chemometric Methods in Molecular Design, VCH, N. Y., 1996, pp 113-157.
-
(1996)
Chemometric Methods in Molecular Design
, pp. 113-157
-
-
Jurs, P.C.1
Dixon, S.L.2
Egolf, L.M.3
-
37
-
-
34848861604
-
-
H. Kubinyi, QSAR: Hansch Analysis and Related Approaches, 1, VC, N. Y., 1993, pp 91-107.
-
H. Kubinyi, QSAR: Hansch Analysis and Related Approaches, Vol. 1, VC, N. Y., 1993, pp 91-107.
-
-
-
-
38
-
-
34848907645
-
Pirouette 3.01, Woodinville, WA
-
Infometrix, Inc
-
Infometrix, Inc., Pirouette 3.01, Woodinville, WA, 2001.
-
(2001)
-
-
-
39
-
-
1642500515
-
-
Switzerland
-
MOLEKEL, P. Flukiger, H. P. Luthi, S. Portmann, J. Weber, Swiss Certer for Scientific Computing, Mano (Switzerland), 2000-2001.
-
(2000)
Swiss Certer for Scientific Computing, Mano
-
-
MOLEKEL, P.1
Flukiger, H.2
Luthi, P.3
Portmann, S.4
Weber, J.5
|