-
2
-
-
0028693381
-
Design of tight-binding human immunodeficiency virus type 1-protease inhibitors
-
J.P. Vacca Design of tight-binding human immunodeficiency virus type 1-protease inhibitors Meth. Enzymol. 241 1994 311 334
-
(1994)
Meth. Enzymol.
, vol.241
, pp. 311-334
-
-
Vacca, J.P.1
-
3
-
-
0028248489
-
HIV protease as an inhibitor target for the treatment of AIDS
-
P.L. Darke, and J.R. Huff HIV protease as an inhibitor target for the treatment of AIDS Adv. Pharmacol. 25 1995 399 454
-
(1995)
Adv. Pharmacol.
, vol.25
, pp. 399-454
-
-
Darke, P.L.1
Huff, J.R.2
-
4
-
-
0030046136
-
Recent advances in HIV-1 protease inhibitors
-
K.T. Chong Recent advances in HIV-1 protease inhibitors Exp. Opin. Invest. Drugs 5 1996 115 124
-
(1996)
Exp. Opin. Invest. Drugs
, vol.5
, pp. 115-124
-
-
Chong, K.T.1
-
5
-
-
0030811307
-
Cyclic HIV protease inhibitors capable of displacing the active-site structural water molecule
-
G.V. De Lucca, S. Erickson-Viitanen, and P.Y.S. Lam Cyclic HIV protease inhibitors capable of displacing the active-site structural water molecule Drug Discovery Today 2 1997 6 18
-
(1997)
Drug Discovery Today
, vol.2
, pp. 6-18
-
-
De Lucca, G.V.1
Erickson-Viitanen, S.2
Lam, P.Y.S.3
-
6
-
-
0023189868
-
A structural model for the retroviral proteases
-
L.H. Pearl, and W.R. Taylor A structural model for the retroviral proteases Nature 329 1987 351 354
-
(1987)
Nature
, vol.329
, pp. 351-354
-
-
Pearl, L.H.1
Taylor, W.R.2
-
7
-
-
0022546859
-
HTLV-III gag protein is processed in yeast cells by the virus pol-protease
-
R.A. Kramer, M.D. Schaber, A.M. Skalka, K. Ganguly, F. Wong-Staal, and E.P. Reddy HTLV-III gag protein is processed in yeast cells by the virus pol-protease Science 231 1986 1580 1584
-
(1986)
Science
, vol.231
, pp. 1580-1584
-
-
Kramer, R.A.1
Schaber, M.D.2
Skalka, A.M.3
Ganguly, K.4
Wong-Staal, F.5
Reddy, E.P.6
-
8
-
-
0023992802
-
An 11-kDa form of human immunodeficiency virus protease expressed in Escherichia coli is sufficient for enzymatic activity
-
M.C. Graves, J.J. Lim, E.P. Heimer, and R.A. Kramer An 11-kDa form of human immunodeficiency virus protease expressed in Escherichia coli is sufficient for enzymatic activity Proc. Natl. Acad. Sci. USA 85 1988 2449 2453
-
(1988)
Proc. Natl. Acad. Sci. USA
, vol.85
, pp. 2449-2453
-
-
Graves, M.C.1
Lim, J.J.2
Heimer, E.P.3
Kramer, R.A.4
-
9
-
-
0024063076
-
Active site mutagenesis of the AIDS virus protease and its alleviation by trans complementation
-
S.F.J. Le Grice, J. Mills, and J. Mous Active site mutagenesis of the AIDS virus protease and its alleviation by trans complementation EMBO J. 7 1988 2547 2553
-
(1988)
EMBO J.
, vol.7
, pp. 2547-2553
-
-
Le Grice, S.F.J.1
Mills, J.2
Mous, J.3
-
10
-
-
0023783663
-
Characterization of human immunodeficiency virus gag/pol gene products expressed by recombinant vaccinia viruses
-
C. Flexner, S.S. Broyles, P. Earl, S. Chakrabarti, and B. Moss Characterization of human immunodeficiency virus gag/pol gene products expressed by recombinant vaccinia viruses Virology 166 1988 339 349
-
(1988)
Virology
, vol.166
, pp. 339-349
-
-
Flexner, C.1
Broyles, S.S.2
Earl, P.3
Chakrabarti, S.4
Moss, B.5
-
11
-
-
0024392730
-
Human immunodeficiency virus-like particles produced by a vaccinia virus expression vector
-
V. Karacostas, K. Nagashima, M.A. Gonda, and B. Moss Human immunodeficiency virus-like particles produced by a vaccinia virus expression vector Proc. Natl. Acad. Sci. USA 86 1989 8964 8967
-
(1989)
Proc. Natl. Acad. Sci. USA
, vol.86
, pp. 8964-8967
-
-
Karacostas, V.1
Nagashima, K.2
Gonda, M.A.3
Moss, B.4
-
12
-
-
0026579208
-
The HIV-1 protease as a therapeutic target for AIDS
-
C. Debouck The HIV-1 protease as a therapeutic target for AIDS AIDS Res. Hum. Retroviruses 8 1992 153 164
-
(1992)
AIDS Res. Hum. Retroviruses
, vol.8
, pp. 153-164
-
-
Debouck, C.1
-
13
-
-
0025005794
-
Effect of two novel inhibitors of the human immunodeficiency virus protease on the maturation of the HIV gag and gag-pol polyproteins
-
H.A. Overton, D.J. McMillan, S.J. Gridley, S. Redshaw, and J.S. Mills Effect of two novel inhibitors of the human immunodeficiency virus protease on the maturation of the HIV gag and gag-pol polyproteins Virology 179 1990 508 511
-
(1990)
Virology
, vol.179
, pp. 508-511
-
-
Overton, H.A.1
McMillan, D.J.2
Gridley, S.J.3
Redshaw, S.4
Mills, J.S.5
-
14
-
-
7244239941
-
Antimicrobial agents: Antiretroviral agents
-
J.G. Hardman L.E. Limbird McGraw-Hill USA
-
S. Raffanti, and D.W. Haas Antimicrobial agents: antiretroviral agents. J.G. Hardman L.E. Limbird The Pharmacological Basis of Therapeutics vol. 10 2001 McGraw-Hill USA 1364
-
(2001)
The Pharmacological Basis of Therapeutics
, vol.10
, pp. 1364
-
-
Raffanti, S.1
Haas, D.W.2
-
15
-
-
0023984621
-
The challenge of characterizing branching in molecular species
-
D.H. Rouvray The challenge of characterizing branching in molecular species Discrete Appl. Math. 19 1988 317 338
-
(1988)
Discrete Appl. Math.
, vol.19
, pp. 317-338
-
-
Rouvray, D.H.1
-
16
-
-
0141733682
-
Graph theoretical analysis of diamagnetic susceptibilities of alkanes and alkenes
-
M. Randic Graph theoretical analysis of diamagnetic susceptibilities of alkanes and alkenes Chem. Phys. Lett. 53 1978 602 605
-
(1978)
Chem. Phys. Lett.
, vol.53
, pp. 602-605
-
-
Randic, M.1
-
17
-
-
84990648083
-
Survey of structural regularities in molecular properties. I. Carbon-13 shifts in alkanes
-
M. Randic Survey of structural regularities in molecular properties. I. Carbon-13 shifts in alkanes Int. J. Quant. Chem. 23 1983 1707 1722
-
(1983)
Int. J. Quant. Chem.
, vol.23
, pp. 1707-1722
-
-
Randic, M.1
-
18
-
-
0021477860
-
On molecular identification numbers
-
M. Randic On molecular identification numbers J. Chem. Inf. Comput. Sci. 24 1984 164 175
-
(1984)
J. Chem. Inf. Comput. Sci.
, vol.24
, pp. 164-175
-
-
Randic, M.1
-
19
-
-
0023981806
-
Determining structural similarity of chemicals using graph-theoretic indices
-
S.C. Basak, V.R. Magnuson, G.J. Niemi, and R.R. Regal Determining structural similarity of chemicals using graph-theoretic indices Discrete Appl. Math. 19 1988 17 44
-
(1988)
Discrete Appl. Math.
, vol.19
, pp. 17-44
-
-
Basak, S.C.1
Magnuson, V.R.2
Niemi, G.J.3
Regal, R.R.4
-
20
-
-
33847029884
-
A new approach for devising local graph invariants: Derived topological indices with low degeneracy and good correlation ability
-
P.A. Philip, T.S. Balaban, and A.T. Balaban A new approach for devising local graph invariants: derived topological indices with low degeneracy and good correlation ability J. Math. Chem. 1 1987 61 83
-
(1987)
J. Math. Chem.
, vol.1
, pp. 61-83
-
-
Philip, P.A.1
Balaban, T.S.2
Balaban, A.T.3
-
21
-
-
0007769159
-
Recent advances in biomedicinal QSAR
-
N.B. Chapman J. Shorter Plenum Press New York
-
C. Hansch Recent advances in biomedicinal QSAR N.B. Chapman J. Shorter Correlation Analysis in Chemistry 1978 Plenum Press New York 397 438
-
(1978)
Correlation Analysis in Chemistry
, pp. 397-438
-
-
Hansch, C.1
-
28
-
-
0027692921
-
Traditional topological indices versus electronic, geometric and combined molecular descriptors in QSAR/QSPR research
-
A.R. Katritzky, and E.V. Gordeeva Traditional topological indices versus electronic, geometric and combined molecular descriptors in QSAR/QSPR research J. Chem. Inf. Comput. Sci. 33 1993 835 857
-
(1993)
J. Chem. Inf. Comput. Sci.
, vol.33
, pp. 835-857
-
-
Katritzky, A.R.1
Gordeeva, E.V.2
-
29
-
-
0028391743
-
Application of graph theoretical parameters in quantifying molecular similarity and structure-activity relationships
-
S.C. Basak, S. Bertlsen, and G.D. Grunwald Application of graph theoretical parameters in quantifying molecular similarity and structure-activity relationships J. Chem. Inf. Comput. Sci. 34 1994 270 276
-
(1994)
J. Chem. Inf. Comput. Sci.
, vol.34
, pp. 270-276
-
-
Basak, S.C.1
Bertlsen, S.2
Grunwald, G.D.3
-
30
-
-
0001677688
-
Edge adjacency relationships and molecular topographic descriptors: Definition and applications
-
E. Estrada, and A. Ramirez Edge adjacency relationships and molecular topographic descriptors: definition and applications J. Chem. Inf. Comput. Sci. 36 1996 837 843
-
(1996)
J. Chem. Inf. Comput. Sci.
, vol.36
, pp. 837-843
-
-
Estrada, E.1
Ramirez, A.2
-
31
-
-
0035225109
-
Search of topological pattern to evaluate the toxicity of heterogeneous compounds
-
R. Garcia-Domenech, J.V. De Julian-Ortiz, M.J. Duart, J.M. Garcia-Torrecillas, G.M. Anton-Fos, I. Rios-Santamarina, C. De Gregorio-Alapont, and J. Galvez Search of topological pattern to evaluate the toxicity of heterogeneous compounds SAR QSAR Environ. Res. 12 2001 237 254
-
(2001)
SAR QSAR Environ. Res.
, vol.12
, pp. 237-254
-
-
Garcia-Domenech, R.1
De Julian-Ortiz, J.V.2
Duart, M.J.3
Garcia-Torrecillas, J.M.4
Anton-Fos, G.M.5
Rios-Santamarina, I.6
De Gregorio-Alapont, C.7
Galvez, J.8
-
32
-
-
0031305152
-
Predicting acute toxicity of benzene derivatives using theoretical molecular descriptors: A hierarchical QSAR approach
-
B.D. Gute, and S.C. Basak Predicting acute toxicity of benzene derivatives using theoretical molecular descriptors: a hierarchical QSAR approach SAR QSAR Environ. Res. 7 1997 117 131
-
(1997)
SAR QSAR Environ. Res.
, vol.7
, pp. 117-131
-
-
Gute, B.D.1
Basak, S.C.2
-
33
-
-
0001219776
-
A newly proposed quantity characterizing the topological nature of structural isomers of saturated hydrocarbons
-
H. Hosoya A newly proposed quantity characterizing the topological nature of structural isomers of saturated hydrocarbons Bull. Chem. Soc. Jpn. 44 1971 2332 2339
-
(1971)
Bull. Chem. Soc. Jpn.
, vol.44
, pp. 2332-2339
-
-
Hosoya, H.1
-
34
-
-
0001650426
-
Topological index as strong sorting device for coding chemical structure
-
H. Hosoya Topological index as strong sorting device for coding chemical structure J. Chem. Doc. 12 1972 181 183
-
(1972)
J. Chem. Doc.
, vol.12
, pp. 181-183
-
-
Hosoya, H.1
-
35
-
-
8644280181
-
On characterization of molecular branching
-
M. Randic On characterization of molecular branching J. Am. Chem. Soc. 97 1975 6609 6615
-
(1975)
J. Am. Chem. Soc.
, vol.97
, pp. 6609-6615
-
-
Randic, M.1
-
36
-
-
0035959183
-
Application of graph theory: Relationship of molecular connectivity index and atomic molecular connectivity index with anti-HSV activity
-
S. Gupta, M. Singh, and A.K. Madan Application of graph theory: relationship of molecular connectivity index and atomic molecular connectivity index with anti-HSV activity J. Mol. Struct. (Theochem.) 571 2001 147 152
-
(2001)
J. Mol. Struct. (Theochem.)
, vol.571
, pp. 147-152
-
-
Gupta, S.1
Singh, M.2
Madan, A.K.3
-
38
-
-
9444296174
-
Highly discriminating distance-based topological indices
-
A.T. Balaban Highly discriminating distance-based topological indices Chem. Phys. Lett. 89 1982 399 404
-
(1982)
Chem. Phys. Lett.
, vol.89
, pp. 399-404
-
-
Balaban, A.T.1
-
39
-
-
33845378719
-
Applications of graph theory in chemistry
-
A.T. Balaban Applications of graph theory in chemistry J. Chem. Inf. Comput. Sci. 25 1985 334 343
-
(1985)
J. Chem. Inf. Comput. Sci.
, vol.25
, pp. 334-343
-
-
Balaban, A.T.1
-
40
-
-
0000824016
-
Computer programme for topological index J (average distance sum connectivity)
-
A.T. Balaban, and P. Filip Computer programme for topological index J (average distance sum connectivity) J. Math. Chem. 16 1984 163 190
-
(1984)
J. Math. Chem.
, vol.16
, pp. 163-190
-
-
Balaban, A.T.1
Filip, P.2
-
41
-
-
0012986327
-
Application of graph theory: Relationship of molecular connectivity index. Wiener's index and eccentric connectivity index with diuretic activity
-
S. Sardana, and A.K. Madan Application of graph theory: relationship of molecular connectivity index. Wiener's index and eccentric connectivity index with diuretic activity Commun. Math. Chem. (MATCH) 43 2001 85 98
-
(2001)
Commun. Math. Chem. (MATCH)
, vol.43
, pp. 85-98
-
-
Sardana, S.1
Madan, A.K.2
-
42
-
-
0346123167
-
Topological models for prediction of antihypertensive activity of substituted benzylimidazoles
-
S. Sardana, and A.K. Madan Topological models for prediction of antihypertensive activity of substituted benzylimidazoles J. Mol. Struct. (Theochem.) 638 2003 41 49
-
(2003)
J. Mol. Struct. (Theochem.)
, vol.638
, pp. 41-49
-
-
Sardana, S.1
Madan, A.K.2
-
43
-
-
0036347566
-
Application of graph theory: Relationship of antimycobacterial activity of quinolone derivatives with eccentric connectivity index and Zagreb group parameters
-
S. Sardana, and A.K. Madan Application of graph theory: relationship of antimycobacterial activity of quinolone derivatives with eccentric connectivity index and Zagreb group parameters Commun. Math. Chem. (MATCH) 45 2002 35 53
-
(2002)
Commun. Math. Chem. (MATCH)
, vol.45
, pp. 35-53
-
-
Sardana, S.1
Madan, A.K.2
-
44
-
-
0036977012
-
Predicting anti-HIV activity of TIBO derivatives: Computational approach using a novel topological descriptor
-
S. Sardana, and A.K. Madan Predicting anti-HIV activity of TIBO derivatives: computational approach using a novel topological descriptor J. Mol. Model. 8 2002 258 265
-
(2002)
J. Mol. Model.
, vol.8
, pp. 258-265
-
-
Sardana, S.1
Madan, A.K.2
-
45
-
-
0037084418
-
Application of graph theory: Relationship of eccentric connectivity index and Wiener's index with anti-inflammatory activity
-
S. Gupta, M. Singh, and A.K. Madan Application of graph theory: relationship of eccentric connectivity index and Wiener's index with anti-inflammatory activity J. Math. Anal. Appl. 266 2002 259 268
-
(2002)
J. Math. Anal. Appl.
, vol.266
, pp. 259-268
-
-
Gupta, S.1
Singh, M.2
Madan, A.K.3
-
46
-
-
0036706729
-
Predicting anticonvulsant activity of benzamides/benzylamine: Computational approach using topological descriptors
-
S. Sardana, and A.K. Madan Predicting anticonvulsant activity of benzamides/benzylamine: computational approach using topological descriptors J. Comput. Aid. Mol. Des. 16 2002 545 550
-
(2002)
J. Comput. Aid. Mol. Des.
, vol.16
, pp. 545-550
-
-
Sardana, S.1
Madan, A.K.2
-
47
-
-
33947441259
-
Correlations of heats of isomerization and differences in heats of vaporization of isomers among paraffin hydrocarbons
-
H. Wiener Correlations of heats of isomerization and differences in heats of vaporization of isomers among paraffin hydrocarbons J. Am. Chem. Soc. 69 1947 2636 2638
-
(1947)
J. Am. Chem. Soc.
, vol.69
, pp. 2636-2638
-
-
Wiener, H.1
-
48
-
-
36849142106
-
Influence of interatomic forces on paraffin properties
-
H. Wiener Influence of interatomic forces on paraffin properties J. Chem. Phys. 15 1947 766
-
(1947)
J. Chem. Phys.
, vol.15
, pp. 766
-
-
Wiener, H.1
-
49
-
-
0000148076
-
Vapour-pressure-temperature relations among the branches paraffin hydrocarbons
-
H. Wiener Vapour-pressure-temperature relations among the branches paraffin hydrocarbons J. Chem. Phys. 15 1948 425 430
-
(1948)
J. Chem. Phys.
, vol.15
, pp. 425-430
-
-
Wiener, H.1
-
50
-
-
0001004896
-
Relationship of physical properties of isomeric alkanes to molecular structure, surface tension, specific dispersion and critical solution temperature in aniline
-
H. Wiener Relationship of physical properties of isomeric alkanes to molecular structure, surface tension, specific dispersion and critical solution temperature in aniline J. Phys. Colloid. Chem. 52 1948 1082 1089
-
(1948)
J. Phys. Colloid. Chem.
, vol.52
, pp. 1082-1089
-
-
Wiener, H.1
-
52
-
-
0028397183
-
Wiener matrix invariants
-
M. Randic, X. Guo, T. Oxely, H. Krishnapriyan, and L. Naylor Wiener matrix invariants J. Chem. Inf. Comput. Sci. 34 1994 361 367
-
(1994)
J. Chem. Inf. Comput. Sci.
, vol.34
, pp. 361-367
-
-
Randic, M.1
Guo, X.2
Oxely, T.3
Krishnapriyan, H.4
Naylor, L.5
-
54
-
-
33845352210
-
Graph theory and molecular orbitals III
-
I. Gutman, and N. Trinajstic Graph theory and molecular orbitals III Chem. Phys. Lett. 17 1972 535 538
-
(1972)
Chem. Phys. Lett.
, vol.17
, pp. 535-538
-
-
Gutman, I.1
Trinajstic, N.2
-
55
-
-
0002938511
-
Eccentric connectivity index: A novel highly discriminating topological descriptor for structure property and structure-activity studies
-
V. Sharma, R. Goswami, and A.K. Madan Eccentric connectivity index: a novel highly discriminating topological descriptor for structure property and structure-activity studies J. Chem. Inf. Comput. Sci. 37 1997 273 282
-
(1997)
J. Chem. Inf. Comput. Sci.
, vol.37
, pp. 273-282
-
-
Sharma, V.1
Goswami, R.2
Madan, A.K.3
-
56
-
-
0033552903
-
Stereospecific synthesis, structure-activity relationship, and oral bioavailability of tetrahydropyrimidin-2-one HIV protease inhibitors
-
G.V. De Lucca, J. Liang, and I. De Lucca Stereospecific synthesis, structure-activity relationship, and oral bioavailability of tetrahydropyrimidin-2-one HIV protease inhibitors J. Med. Chem. 42 1999 135 152
-
(1999)
J. Med. Chem.
, vol.42
, pp. 135-152
-
-
De Lucca, G.V.1
Liang, J.2
De Lucca, I.3
-
57
-
-
0034798063
-
Predicting anti-HIV activity: Computational approach using novel topological descriptor
-
S. Gupta, M. Singh, and A.K. Madan Predicting anti-HIV activity: computational approach using novel topological descriptor J. Comput. Aid. Mol. Des. 15 2001 671 678
-
(2001)
J. Comput. Aid. Mol. Des.
, vol.15
, pp. 671-678
-
-
Gupta, S.1
Singh, M.2
Madan, A.K.3
-
58
-
-
0032580479
-
HIV-protease inhibitors
-
C. Flexner HIV-protease inhibitors N. Eng. J. Med. 338 1998 1281 1292
-
(1998)
N. Eng. J. Med.
, vol.338
, pp. 1281-1292
-
-
Flexner, C.1
-
59
-
-
0036888374
-
Six-membered cyclic ureas as HIV-1 protease inhibitors: A QSAR study based on CODESSA PRO approach
-
A.R. Katritzky, A. Oliferenko, A. Lomakab, and M. Karelsonb Six-membered cyclic ureas as HIV-1 protease inhibitors: a QSAR study based on CODESSA PRO approach Bioorg. Med. Chem. Lett. 12 2002 3453 3457
-
(2002)
Bioorg. Med. Chem. Lett.
, vol.12
, pp. 3453-3457
-
-
Katritzky, A.R.1
Oliferenko, A.2
Lomakab, A.3
Karelsonb, M.4
-
60
-
-
0037075124
-
Computational studies on tetrahydropyrimidin-2-one HIV-1 protease inhibitors: Improving three-dimensional quantitative structure-activity relationship. Comparative molecular field analysis models by inclusion of calculated inhibitor and receptor based properties
-
A.C. Nair, P. Jayatilleke, X. Wang, S. Miertus, and W.J. Welsh Computational studies on tetrahydropyrimidin-2-one HIV-1 protease inhibitors: improving three-dimensional quantitative structure-activity relationship. Comparative molecular field analysis models by inclusion of calculated inhibitor and receptor based properties J. Med. Chem. 45 2002 973 983
-
(2002)
J. Med. Chem.
, vol.45
, pp. 973-983
-
-
Nair, A.C.1
Jayatilleke, P.2
Wang, X.3
Miertus, S.4
Welsh, W.J.5
|