Janežič, Dušanka, 1952-
Janežič, Dušanka.
Dušanka Janežič Slovene mathematician
VIAF ID: 305515660 ( Personal )
Permalink: http://viaf.org/viaf/305515660
Preferred Forms
- 100 0 _ ‡a Dušanka Janežič ‡c Slovene mathematician
- 100 1 _ ‡a Janežič, Dušanka
- 100 1 _ ‡a Janežič, Dušanka
- 100 1 _ ‡a Janežič, Dušanka
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- 100 1 _ ‡a Janežič, Dušanka, ‡d 1952-
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4xx's: Alternate Name Forms (10)
Works
Title | Sources |
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Binding site prediction algorithms in pharmaceutical discovery | |
Binding-sites prediction assisting protein-protein docking | |
BoBER web interface to the base of bioisosterically exchangeable replacements | |
A branch and bound algorithm for matching protein structures | |
Computer simulation of structure and dynamics of proteins | |
An efficient symplectic integration algorithm for molecular dynamics simulations | |
ENZO a web tool for derivation and evaluation of kinetic models of enzyme catalyzed reactions | |
Fast parallel molecular simulations | |
From mathematics to drug development | |
Graph-theoretical matrices in chemistry / Dušanka Janežič, Ante Miličević, Sonja Nikolić [et al.]. - Boca Raton, 2017. | |
Hamiltonian splitting methods for macromolecular simulation | |
Harmonic analysis of large systems. | |
Hosoya matrices as the numerical realization of graphical matrices and derived structural descriptors | |
Implementation and evaluation of MPI-based parallel MD program | |
Interactions of indomethacin with functionalized rhombellanes : a molecular docking study | |
Long time step MD simulations using split integration symplectic method | |
Molecular dynamics integration and molecular vibrational theory : [invited lecture] | |
Molecular modeling - a new approach | |
Molecular surface walk : [poster] | |
New algorithm for the maximum clique problem | |
ProBiS : a web server for detection of structurally similar protein binding sites | |
ProBiS tools algorithm, database, and web-server for predicting and modeling of pharmaceutically interesting proteins | |
ProBiSdock flexible docking using existing knowledge from the Protein Data Bank | |
Problem maksimalne klike na neusmerjenih grafih : magistrska naloga | |
Professor Nenad Trinajstić: distinguished researcher in mathematical chemistry | |
Protein surface-visualisation and possible function prediction with MNSP descriptors : [lecture] | |
QM/MM study of the Burkholderia cepacia lipase catalysed secondary alcohol esterification : [lecture] | |
Quantum chemical calculations of energetic levels of intermediates in U-4CR : [poster] | |
Računalniško modeliranje strukture in dinamike proteinov : letno poročilo o rezultatih raziskovalnega projekta v letu 1997 : številka projekta J1-7346, številka pogodbe 3411-97-21-7346 | |
Razvoj spletnega uporabniškega vmesnika za program molekularnega sidranja = Development of web user interface for molecular docking algorithm : zaključna naloga | |
Redistribution of lipids inside the membrane - a prelude to formation of lipid rafts? | |
The regional biophysics meeting, March 16-20, 2005, Zreče, Slovenia | |
Repurposing of drugs for SARS-CoV-2 using inverse docking fingerprints | |
Reviews in Computational Chemistry. Volume 19. Edited by Kenny B. Lipkowitz, Raima Larter, and Thomas R. Cundari. Wiley-VCH: Hoboken, NJ, 2003. xxiv+393 pp. ISBN 0-471-23585-7 : book review | |
RISM study of the structure of water at the hydrophobic wall | |
Role of magnesium ions in the reaction mechanism at the interface between Tm1631 protein and its DNA ligand | |
Scaffold hopping and bioisosteric replacements based on binding site alignments | |
Simulacija molekulske dinamike z uporabo nove simplektične metode z dolgim integracijskim korakom : diplomsko delo | |
Simulations of macromolecules : improvements of MD efficiency : [poster presented at XIIth Onternational Biophysics Congress, 11-16 August 1996, Amsterdam, The Netherlands] | |
Simulations par ordinateur de la structure et de la dynamique des protéines : co-opération PROTEUS, rapport = Računalniške simulacije strukture in dinamike proteinov : sodelovanje PROTEUS, poročilo | |
The simultaneous [alpha]-addition of a cation and an anion onto an isocyanide | |
Slovenske znanstvenice se počutijo močno diskriminirane moških problematika enakosti med spoloma ne zanima | |
Specialized network topologies for efficient communication in computer clusters : [lecture] | |
The status of Slovenian women in science | |
Structural-based function prediction in uncharacterized protein | |
Structure and stability of elongated carbon nanostructures : PhD Thesis | |
Študij atomskih porazdelitvenih funkcij v klasičnih tekočinah s pomočjo teorije integralskih enačb | |
Študij proteinov s pomočjo harmonske in molekulske dinamike = Comparison of harmonic dynamics with molecular dynamics for proteins | |
Surface-tension of water - Fowler model | |
Symplectic integration of Hamiltonian systems | |
Temperaturna odvisnost vibracijskega spektra vode : [poster] | |
Topological complexity of molecules | |
Trends of molecular modeling and process simulation in Slovenia : existing projects and possible industrial applications | |
Uporaba metod molekularnega modeliranja za študij interakcij bioloških makromolekul : doktorska disertacija | |
Use of molecular modeling to design enzyme inhibitors as potential antibacterial agents | |
Uvod v uporabo graf-teoretičnih matrik v kemiji : magistrska naloga | |
Virtual screening for inhibitors of D-alanine:D-alanine ligase | |
Vzporedni računalniki in molekulska dinamika | |
Wienerjev indeks in sorodne invarante grafov : magistrsko delo | |
Z računalnikom do vpogleda v strukturo in gibanje molekul | |
Za kolege v tujini smo zdaj že enakopravni partnerji, le pri opremi seveda precej zaostajamo : dr. Dušanka Janežič o uspehih slovenskih naravoslovcev v tujini | |
Za ženske v znanosti drugačen meter kot za moške | |
Zagreb indices: extension to weighted graphs representing molecules containing heteroatoms |