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Results 1 to 25 of 1112

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Modeling based on subspace orthogonal projections for QSAR and QSPR researchYIZENG LIANG; DALIN YUAN; QINGSONG XU et al.Journal of chemometrics. 2008, Vol 22, Num 1-2, pp 23-35, issn 0886-9383, 13 p.Article

Synthesis and anthelmintic activity of osthol analogs against Dactylogyrus intermedius in goldfishLIU, Guang-Lu; BING HAO; LIU, Shao-Peng et al.European journal of medicinal chemistry. 2012, Vol 54, pp 582-590, issn 0223-5234, 9 p.Article

Synthesis, characterization, biological evaluation and QSAR studies of 11-p-substituted phenyl-12-phenyl-11a,12-dihydro-11H-indeno[2,1-c][1,5 benzothiazepines as potential antimicrobial agentsMOR, Satbir; PAHAL, Preeti; NARASIMHAN, Balasubramanian et al.European journal of medicinal chemistry. 2012, Vol 57, pp 196-210, issn 0223-5234, 15 p.Article

Structure-activity relationship study of human liver microsomes-catalyzed hydrolysis rate of ester prodrugs of MENT by comparative molecular field analysis (CoMFA)BURSI, Roberta; GROOTENHUIS, Arijan; VAN DER LOUW, Jaap et al.Steroids. 2003, Vol 68, Num 3, pp 213-220, issn 0039-128X, 8 p.Article

Receptor Dependent Multidimensional QSAR for Modeling Drug Receptor InteractionsPOLANSKI, Jaroslaw.Current medicinal chemistry. 2009, Vol 16, Num 25, pp 3243-3257, issn 0929-8673, 15 p.Article

Predictive QSAR Modeling Workflow, Model Applicability Domains, and Virtual ScreeningTROPSHA, Alexander; GOLBRAIKH, Alexander.Current pharmaceutical design. 2007, Vol 13, Num 34, pp 3494-3504, issn 1381-6128, 11 p.Article

Isoxazolo(aza)naphthoquinones: A new class of cytotoxic Hsp90 inhibitorsBARGIOTTI, Alberto; MUSSO, Loana; CASTORINA, Massimo et al.European journal of medicinal chemistry. 2012, Vol 53, pp 64-75, issn 0223-5234, 12 p.Article

Ligand-based design, in silico ADME-Tox filtering, synthesis and biological evaluation to discover new soluble 1,4-DHP-based CFTR activatorsVISENTIN, Sonja; ERMONDI, Giuseppe; MEDANA, Claudio et al.European journal of medicinal chemistry. 2012, Vol 55, pp 188-194, issn 0223-5234, 7 p.Article

QSPR modeling of the enthalpy of formation based on Partial Order RankingCASTRO, Eduardo A; FERNANDEZ, Francisco M; DUCHOWICZ, Pablo R et al.Journal of mathematical chemistry. 2005, Vol 37, Num 4, pp 433-441, issn 0259-9791, 9 p.Article

Machine Learning Techniques and Drug DesignGERTRUDES, J. C; MALTAROLLO, V. G; SILVA, R. A et al.Current medicinal chemistry. 2012, Vol 19, Num 25, pp 4289-4297, issn 0929-8673, 9 p.Article

On further application of r2m as a metric for validation of QSAR modelsMITRA, Indrani; PARTHA PRATIM ROY; KAR, Supratik et al.Journal of chemometrics. 2010, Vol 24, Num 1-2, pp 22-33, issn 0886-9383, 12 p.Article

Correlation weighted successive projections algorithm as a novel method for variable selection in QSAR studies : investigation of anti-HIV activity of HEPT derivativesKOMPANY-ZAREH, Mohsen; AKHLAGHI, Yousef.Journal of chemometrics. 2007, Vol 21, Num 5-6, pp 239-250, issn 0886-9383, 12 p.Article

SMILES-based optimal descriptors: QSAR modeling of carcinogenicity by balance of correlations with ideal slopesTOROPOV, A. A; TOROPOVA, A. P; BENFENATI, E et al.European journal of medicinal chemistry. 2010, Vol 45, Num 9, pp 3581-3587, issn 0223-5234, 7 p.Article

Biochemical and pharmacological evaluation of 4-hydroxychromen-2-ones bearing polar C-3 substituents as anticoagulantsMLADENOVIC, Milan; MIHAILOVIC, Mirjana; SOLUJIC, Slavica et al.European journal of medicinal chemistry. 2012, Vol 54, pp 144-158, issn 0223-5234, 15 p.Article

3D QSAR studies on antimalarial alkoxylated and hydroxylated chalcones by CoMFA and CoMSIAXUE, C. X; CUI, S. Y; LIU, M. C et al.European journal of medicinal chemistry. 2004, Vol 39, Num 9, pp 745-753, issn 0223-5234, 9 p.Article

Design, synthesis and 3D-QSAR analysis of novel 2-hydrazinyl-4-morpholinothieno[3,2-d]pyrimidine derivatives as potential antitumor agentsWUFU ZHU; YAJING LIU; XIN ZHAI et al.European journal of medicinal chemistry. 2012, Vol 57, pp 162-175, issn 0223-5234, 14 p.Article

SYMPOSIUM METHODES AVANCEES QSAR, SESSION DE PERFECTIONNEMENT DES ECOLES EUROPEENNES D'ETE, PARIS, 16-18 MARS 19791979; METHODES AVANCEES QSAR. SYMPOSIUM. ECOLES EUROPEENNES D'ETE SESSION DE PERFECTIONNEMENT/1979-03-16/PARIS; FRA; DA. 1979; PAG. MULT.: ILL.; 30 CM; BIBL. DISSEM.Conference Proceedings

Inhibition of immune complex-mediated neutrophil oxidative metabolism : A pharmacophore model for 3-phenylcoumarin derivatives using GRIND-based 3D-QSAR and 2D-QSAR proceduresKABEYA, Luciana M; DA SILVA, Carlos H. T. P; KANASHIRO, Alexandre et al.European journal of medicinal chemistry. 2008, Vol 43, Num 5, pp 996-1007, issn 0223-5234, 12 p.Article

Molecular Docking and QSAR Studies: Noncovalent Interaction between Acephate Analogous and the Receptor Site of Human AcetylcholinesteraseGHOLIVAND, Khodayar; ALI ASGHAR EBRAHIMI VALMOOZI; MAHZOUNI, Hamid R et al.Journal of agricultural and food chemistry (Print). 2013, Vol 61, Num 28, pp 6776-6785, issn 0021-8561, 10 p.Article

Quantitative consensus of bioaccumulation models for integrated testing strategiesFERNANDEZ, Alberto; LOMBARDO, Anna; RALLO, Robert et al.Environment international. 2012, Vol 45, pp 51-58, issn 0160-4120, 8 p.Article

Syntheses, antifeedant activity, and QSAR analysis of new oxa(thia)diazolyl 3(2H)-pyridazinonesSONG CAO; NA WEI; CHUANMENG ZHAO et al.Journal of agricultural and food chemistry (Print). 2005, Vol 53, Num 8, pp 3120-3125, issn 0021-8561, 6 p.Article

New pyrimido[5,4-e]pyrrolo[1,2-c]pyrimidines: Synthesis, 2D-QSAR, anti-inflammatory, analgesic and ulcerogenicity studiesHANNA, Mona M.European journal of medicinal chemistry. 2012, Vol 55, pp 12-22, issn 0223-5234, 11 p.Article

Synthesis of Rubrolide Analogues as New Inhibitors of the Photosynthetic Electron Transport ChainBARBOSA, Luiz C. A; MALTHA, Célia R. A; LAGE, Mateus R et al.Journal of agricultural and food chemistry (Print). 2012, Vol 60, Num 42, pp 10555-10563, issn 0021-8561, 9 p.Article

Cryptes connues et inconnues des temples tardifs = Knows and unknows crypts of late tempelsTRAUNECKER, C.Bulletin de la Société française d'égyptologie. 1994, Num 129, pp 21-46, issn 0037-9379Article

Methods for assigning confidence to toxicity data with multiple values — Identifying experimental outliersSTEINMETZ, Fabian P; ENOCH, Steven J; MADDEN, Judith C et al.Science of the total environment. 2014, Vol 482-483, pp 358-365, issn 0048-9697, 8 p.Article

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