Kazan Federal University Digital Repository
III Международная летняя школа-конференция по хемоинформатике (Казань, 5-7 июля 2017 г.)
Login
русский
English
Home
→
Конференции, круглые столы, семинары КФУ
→
III Международная летняя школа-конференция по хемоинформатике (Казань, 5-7 июля 2017 г.)
JavaScript is disabled for your browser. Some features of this site may not work without it.
III Международная летняя школа-конференция по хемоинформатике (Казань, 5-7 июля 2017 г.)
Browse by
By Issue Date
Authors
Titles
Subjects
Search within this collection:
Recent Submissions
STRUCTURE-BASED VIRTUAL SCREENING OF NEW SELECTIVE INHIBITORS OF IMIDAZOLEGLYCEROL-PHOSPHATE DEHYDRATASE FROM MYCOBACTERIUM TUBERCULOSIS
Mandzhieva J.
;
Timofeev V.
;
Sidorov-Biryukov D.
;
Podshivalov D.
(
2017
)
QUANTUM-CHEMICAL QSAR-MODELING OF NA+/H+ EXCHANGER 1 INHIBITORS BASED ON THE CONSENSUS OF NEURAL NETWORKS
Gnidenko M.
;
Vassiliev P.
;
Gurova N.
;
Muravyeva V.
(
2017
)
PREDICTION OF METABOLIC TRANSFORMATIONS OF ORGANIC COMPOUNDS BY CYP1A2 ISOENZYME USING СONDENSED GRAPH OF REACTIONS
Khakimova A.
;
Nugmanov R.
;
Madzhidov T.
;
Varnek A.
(
2017
)
QUANTUM-CHEMICAL ESTIMATION OF THE DIMERIZATION EFFECT ON THE ACID-BASE PROPERTIES OF GLYCINE
Pustolaikina I.A.
;
Kutzhanova K.Zh.
;
Kurmanova A.F.
(
2017
)
DIRECTED SEARCH FOR NOVEL Α-GLUCOSIDASE INHIBITORS USING STRUCTURE SIMILARITY WITH TESTED SUBSTANCES
Klochkov V.
;
Vassiliev P.
;
Babkov D.
(
2017
)
QSAR-MODELING OF BIS-AZAAROMATIC QUATERNARY AMMONIUM ORGANIC SALTS WITH NOOTROPIC ACTIVITY
Akbasheva Ju.Z.
;
Rakhmatullina S.R.
;
Khayrullina V.R.
;
Gerchikov A.Ja.
(
2017
)
IN SILICO TARGETS AND PATHWAYS PREDICTION FOR A NOVEL MULTICOMPONENT POLYPHENOLIC LIGNIN-DERIVED COMPOSITION BP-CX
Gubareva E.A.
;
Izotova E.I.
;
Fedoros E.I.
;
Panchenko A.V.
(
2017
)
HOMOLOGY MODELING AND MOLECULAR DYNAMICS STUDIES OF THE OLIGOPEPTIDASE B FROM SERRATIA PROTEAMACULANS. INSIGHTS INTO THE ENZYMATIC ACTIVATION MECHANISM
Agapova J.
;
Talyzina A.
;
Karlinsky D.
;
Podshivalov D.
;
Zeyfman J.
;
Timofeev V.
;
Rakitina T.
(
2017
)
ARTIFICIAL NEURAL NETWORKS, SUPPORT VECTOR MACHINES AND DECISION TREES FOR ANTI HIV ACTIVITY PREDICTION OF ORGANIC COMPOUNDS
Hdoufane I.
;
Bjij I.
;
Cherqaoui D.
(
2017
)
DEVELOPMENT OF A PREDICTION' PERFORMANCE METRIC FOR CHEMICAL REACTIONS' MODELS
Akhmetshin T.N.
;
Nugmanov R.I.
;
Madzhidov T.I.
;
Varnek A.
(
2017
)
AUTOMATIC SYSTEM FOR PREDICTION OF OPTIMAL CONDITION FOR HYDROGENATION REACTIONS
Afonina V.
;
Lin A.
;
Madzhidov T.
;
Nugmanov R.
;
Antipin I.
;
Klimchuk O.
;
Varnek A.
(
2017
)
A NEW APPROACH TO PREDICT OPTIMAL SALINITIES FOR SURFACTANT FORMULATIONS
Martin X.
;
Oukhemanou F.
;
Creton B.
(
2017
)
MOLECULAR RECOMMENDATION ENGINE FOR MULTI-PROPERTIES OPTIMIZATION
Clary A.
;
Gohier A.
;
Theret I.
;
Ducrot P.
(
2017
)
QUANTUM CHEMICAL STUDY OF N-SUBSTITUTED ARYLAMINES AS ANALYTICAL REAGENTS
Burmistrova N.A.
;
Zubareva I.S.
(
2017
)
3D MOLECULAR FRAGMENT DESCRIPTORS FOR STRUCTURE-PROPERTY MODELING
Solov'ev V.
;
Solovev A.
(
2017
)
THE INFLUENCE OF LEWIS BASES ON THE LIQUID-CRYSTALLINE AND PHOTOPHYSICAL PROPERTIES OF LANTHANIDE(III) COMPLEXES
Romanova K.A.
;
Galyametdinov Yu.G.
(
2017
)
COMPUTER-AIDED PREDICTION OF MULTITARGET PROFILES: CASE STUDIES FOR CLOZAPINE AND DASATINIB
Murtazalieva K.
;
Poroikov V.
(
2017
)
A COMPUTATIONAL STUDY OF METAL-ORGANIC FRAMEWORKS OXIDATIVE DEGRADATION FOR THE DESIGN OF TUNABLE SMART DRUG DELIVERY SYSTEMS
Khramenkova E.
;
Pidko E.
(
2017
)
P38α MAP KINASE INHIBITORS: PHARMACOPHORE MODELING, 3D-QSAR, DOCKING AND DRUG LIKELINESS PREDICTION
Khan M.F.
;
Verma G.
;
Akhtar W.
;
Alam M.M.
;
Shaquiquzzaman M.
(
2017
)
HOW SHOULD ONE USE AVAILABLE DATA TO BE SUCCESSFUL IN COMPUTER-AIDED SEARCH FOR NOVEL KINASE INHIBITORS?
Pogodin P.
;
Lagunin A.
;
Filimonov D.
;
Rudik A.
;
Poroikov V.
(
2017
)
View more
Search DSpace
Search DSpace
This Collection
Advanced Search
Browse
All of Kazan Federal University Digital Repository
Communities & Collections
By Issue Date
Authors
Titles
Subjects
This Collection
By Issue Date
Authors
Titles
Subjects
My Account
Login
Register
Discover
Author
Varnek A. (12)
Nugmanov R. (7)
Madzhidov T. (6)
Vassiliev P. (5)
Gerchikov A.Ja. (4)
Khayrullina V.R. (4)
Madzhidov T.I. (4)
Podshivalov D. (4)
Poroikov V. (4)
Timofeev V. (4)
... View More
Subject
decision trees (1)
HIV inhibitors (1)
random forests and artificial neural networks (1)
structure activity relationship (1)
support vector machines (1)
TIBO (1)
... View More
Date Issued
2017 (72)
Statistics
View Usage Statistics
View Search Statistics
View Workflow Statistics
RSS Feeds
RSS 1.0
RSS 2.0
Atom