Search results for "molecules"

Hits ?▲	Authors	Title	Venue	Year	Link	Author keywords
77	Peter Willett 0002	Chemoinformatics: an application domain for information retrieval techniques.	SIGIR	2004	DBLP DOI BibTeX RDF	substructure searching, relevance feedback, data fusion, similarity searching, chemistry, virtual screening, molecules, cluster hypothesis, chemoinformatics
75	Boris Hollas, Rainer Schuler	A Stochastic Approach to Count RNA Molecules Using DNA Sequencing Methods.	WABI	2003	DBLP DOI BibTeX RDF
71	Eric-Wubbo Lameijer, Adriaan P. IJzerman, Joost N. Kok	Using data mining to improve mutation in a tool for molecular evolution.	Congress on Evolutionary Computation	2005	DBLP DOI BibTeX RDF
63	David B. Janes, Subhasis Ghosh, Jaewon Choi, Saurabh Lodha	Circuit Characteristics of Molecular Electronic Components.	ASAP	2003	DBLP DOI BibTeX RDF
55	Árpád Csurgay, Craig S. Lent, Wolfgang Porod	Why is Time-Varying Control Necessary for Signal Processing with Locally-Connected Quantum-Dot Arrays?	Great Lakes Symposium on VLSI	1999	DBLP DOI BibTeX RDF
54	Johannes W. Kruisselbrink, Thomas Bäck, Adriaan P. IJzerman, Eelke van der Horst	Evolutionary algorithms for automated drug design towards target molecule properties.	GECCO	2008	DBLP DOI BibTeX RDF	evolutionary algorithms, drug design, molecules
54	Natasa Jonoska, Phiset Sa-Ardyen, Nadrian C. Seeman	Computation by Self-assembly of DNA Graphs.	Genet. Program. Evolvable Mach.	2003	DBLP DOI BibTeX RDF	junction molecules, ligation, graphs, DNA-computing, self-assembly, 3-SAT
54	Phiset Sa-Ardyen, Natasa Jonoska, Nadrian C. Seeman	Self-assembling DNA graphs.	Nat. Comput.	2003	DBLP DOI BibTeX RDF	junction molecules, ligation, graphs, DNA computing, self-assembly
52	Daniel Baum	Multiple Semi-flexible 3D Superposition of Drug-Sized Molecules.	CompLife	2005	DBLP DOI BibTeX RDF
47	Teeroumanee Nadan, Adrian Haffegee, Kimberly Watson	Collaborative and Parallelized Immersive Molecular Docking.	ICCS (2)	2009	DBLP DOI BibTeX RDF	Virtual Reality, collaborative, parallelization, immersion, molecular visualization
47	Vladimir Kvasnicka, Jiri Pospichal, T. Kaláb	A Study of Replicators and Hypercycles by Typogenetics.	ECAL	2001	DBLP DOI BibTeX RDF
44	Hiroki Uejima, Masami Hagiya, Satoshi Kobayashi	Horn Clause Computation by Self-assembly of DNA Molecules.	DNA	2001	DBLP DOI BibTeX RDF
44	Laxmi Parida, Dan Geiger	Mass Estimation of DNA Molecules and Extraction of Ordered Restriction Maps in Optical Mapping Imagery.	Algorithmica	1999	DBLP DOI BibTeX RDF	Flip cut, Optical mapping, Shortest path algorithm
42	Jan Karbowski, G. Bard Ermentrout	Model of the Early Development of Thalamo-Cortical Connections and Area Patterning via Signaling Molecules.	J. Comput. Neurosci.	2004	DBLP DOI BibTeX RDF	thalamo-cortical connections, cortical area patterning, signaling molecules, development, cerebral cortex
39	Paulo H. Acioli, Narin Ratanavade, Michael R. Cline, Sudha Srinivas	Density Functional Theory Study of Ag-Cluster/CO Interactions.	ICCS (2)	2009	DBLP DOI BibTeX RDF
39	Angela M. Pagano, Sammy D. Pishanider, Susannah Gal	Incorporation and use of modified nucleotides in aqueous DNA computing.	Nat. Comput.	2008	DBLP DOI BibTeX RDF	Binding proteins, Fluorescent DNA, Modified nucleotides, Satisfiability problems, Antibodies
39	Sam Bryfczynski	OrganicPad: a tablet PC based chemistry tool.	ACM Southeast Regional Conference	2008	DBLP DOI BibTeX RDF
39	Ravi K. Venkatesan, Ahmed S. Al-Zawawi, Krishnan Sivasubramanian, Eric Rotenberg	ZettaRAM: A Power-Scalable DRAM Alternative through Charge-Voltage Decoupling.	IEEE Trans. Computers	2007	DBLP DOI BibTeX RDF	memory technology, dynamic voltage scaling, DRAM, molecular electronics, molecular memory, low-power memory
39	Yuki Moritani, Satoshi Hiyama, Tatsuya Suda	Molecular Communication for Health Care Applications.	PerCom Workshops	2006	DBLP DOI BibTeX RDF
38	Rudy van Vliet, Hendrik Jan Hoogeboom, Grzegorz Rozenberg	The Construction of Minimal DNA Expressions.	Nat. Comput.	2006	DBLP DOI BibTeX RDF	minimal DNA expressions, formal language, constructions, DNA molecules
38	Darryl J. Bornhop, M. P. Houlne	Spectroscopic Imaging of Tissues Using Micro-Endoscopy.	CBMS	1995	DBLP DOI BibTeX RDF	fluorescence, spectroscopic imaging of tissues, microendoscopy, CCD imaging technology, visual access, spectrometer, molecular fluorescence phenomena, wavelength, wavelength sorting, CCD imaging, remote imaging, biological cell imaging results, fluorescent molecules, chelate complexes, osteosarcoma tissue, bone cancer tissue, molecular site selectivity, osteosarcoma rat host, interstitial fluid flow, osteosarcoma tumors, medical image processing, position, biomedical imaging
36	Elena Angeli, Chiara Manneschi, Luca Repetto, Giuseppe Firpo, Corrado Boragno, Ugo Valbusa	Fabrication of Elastomeric Nanofluidic Devices for Manipulation of Long DNA Molecules.	NanoNet	2009	DBLP DOI BibTeX RDF	Nanochannels, DNA Separation, Nanoconfinement, PDMS
36	Rajesh Bhasin, Abhishek Kumar	ProVis: An Anaglyph based Visualization Tool for Protein Molecules.	IHCI	2009	DBLP DOI BibTeX RDF
36	Leander Schietgat, Jan Ramon, Maurice Bruynooghe, Hendrik Blockeel	An Efficiently Computable Graph-Based Metric for the Classification of Small Molecules.	Discovery Science	2008	DBLP DOI BibTeX RDF
36	Yuval Inbar, Dina Schneidman-Duhovny, Oranit Dror, Ruth Nussinov, Haim J. Wolfson	Deterministic Pharmacophore Detection Via Multiple Flexible Alignment of Drug-Like Molecules.	RECOMB	2007	DBLP DOI BibTeX RDF	Computer-Aided Drug Design (CADD), Rational Drug Discovery, 3D Molecular Similarity, 3D Molecular Superposition
36	Carolina Wählby, Patrick Karlsson, Sara Henriksson, Chatarina Larsson, Mats F. Nilsson, Ewert Bengtsson	Finding Cells, Finding Molecules, Finding Patterns.	MDA	2007	DBLP DOI BibTeX RDF
36	Hao Yu, Minlie Huang, Xiaoyan Zhu 0001, Yabin Guo	A Novel Kernel-Based Approach for Predicting Binding Peptides for HLA Class II Molecules.	ISBRA	2007	DBLP DOI BibTeX RDF	kernel-based, SVM, HLA, string kernel
36	Hongqi Ai, Xian Peng, Yun Li, Chong Zhang	Regulative Effect of Water Molecules on the Switches of Guanine-Cytosine (GC) Watson-Crick Pair.	International Conference on Computational Science (2)	2007	DBLP DOI BibTeX RDF
36	Guo-Zheng Li 0001, Hao-Hua Meng, Mary Qu Yang, Jack Y. Yang	Asymmetric Bagging and Feature Selection for Activities Prediction of Drug Molecules.	IMSCCS	2007	DBLP DOI BibTeX RDF	Feature Selection, Ensemble Learning, Bagging, QSAR, QSAR
36	Matt Coatney, Srinivasan Parthasarathy 0001	MotifMiner: Efficient discovery of common substructures in biochemical molecules.	Knowl. Inf. Syst.	2005	DBLP DOI BibTeX RDF	Substructure discovery, Macromolecules, Cheminformatics, Bioinformatics, Frequent-pattern discovery
36	Matt Coatney, Srinivasan Parthasarathy 0001	MotifMiner: A General Toolkit for Efficiently Identifying Common Substructures in Molecules.	BIBE	2003	DBLP DOI BibTeX RDF
36	Jean-Daniel Boissonnat, Frédéric Cazals, Julia Flötotto	2D-Structure Drawings of Similar Molecules.	GD	2000	DBLP DOI BibTeX RDF
36	Bahram Parvin, C. Peng, William E. Johnston, Marcos Maestre	Tracking of Tubular Molecules for Scientific Applications.	IEEE Trans. Pattern Anal. Mach. Intell.	1995	DBLP DOI BibTeX RDF
34	Patrick Maier 0002, Marcus Tönnis, Gudrun Klinker, Alexander Raith, Markus Drees, Fritz Kuhn	What do you do when two hands are not enough? interactive selection of bonds between pairs of tangible molecules.	3DUI	2010	DBLP DOI BibTeX RDF	interactive selection, tangible molecules, chemical structure, 3D spatial extent, AR-based system, optical marker, molecular bonds, gesture-based technique, shake-based technique, proximity-based technique, augmented reality, tangible interaction, dynamic behavior, molecular modeling, 3D structure, chemical reaction
32	Wen Zhang 0008, Juan Liu, Yanqing Niu	Quantitative prediction of MHC-II peptide binding affinity using relevance vector machine.	Appl. Intell.	2009	DBLP DOI BibTeX RDF	Quantitative prediction, MHC-II peptide binding, Pattern recognition, Relevance vector machine
32	Irene Luque Ruiz, Miguel Ángel Gómez-Nieto	A Java Tool for the Management of Chemical Databases and Similarity Analysis Based on Molecular Graphs Isomorphism.	ICCS (2)	2008	DBLP DOI BibTeX RDF	similarity and diversity analysis, chemical database management, Java, matching, isomorphism, Computational chemistry
32	Georges H. Patterson, Eric Betzig, Jennifer Lippincott-Schwartz, Harald F. Hess	Developing Photoactivated Localization Microscopy (PALM).	ISBI	2007	DBLP DOI BibTeX RDF
32	Michael L. Blinov, Ion I. Moraru	XML Encoding of Features Describing Rule-Based Modeling of Reaction Networks with Multi-Component Molecular Complexes.	BIBE	2007	DBLP DOI BibTeX RDF
32	Angela M. Pagano, Susannah Gal	An Approach for Using Modified Nucleotides in Aqueous DNA Computing.	DNA	2007	DBLP DOI BibTeX RDF
32	Ping Zhu, Xuqing Tang, Zhenyuan Xu, Weihong Guan	The Algebraic Computing Structure of Four DNA Bases.	ICAT Workshops	2006	DBLP DOI BibTeX RDF	natural operation, double and single strands, semi-ring, DNA computing
32	Eric-Wubbo Lameijer, Thomas Bäck, Joost N. Kok, Adriaan P. IJzerman	Evolutionary Algorithms in Drug Design.	Nat. Comput.	2005	DBLP DOI BibTeX RDF	conformational analysis, de novo design, library design, ligand docking, molecule superposition, quantitative structure-activity relationships, genetic algorithms, evolutionary algorithms, drug design
32	Christian Borgelt, Michael R. Berthold, David E. Patterson	Molecular Fragment Mining for Drug Discovery.	ECSQARU	2005	DBLP DOI BibTeX RDF
32	Liliana Félix, Gabriel Valiente, Francesc Rosselló	Optimal Artificial Chemistries and Metabolic Pathways.	ENC	2005	DBLP DOI BibTeX RDF
32	Cheng Fu, Zhengwei Qi, Jinyuan You	A BioAmbients Based Framework for Chain-Structured Biomolecules Modelling.	CIS	2004	DBLP DOI BibTeX RDF
32	Raimar Löbenberg	Smart Materials: Applications of Nanotechnology in Drug Delivery and Drug Targeting.	ICMENS	2003	DBLP DOI BibTeX RDF
32	Maxim Shatsky, Ruth Nussinov, Haim J. Wolfson	MultiProt - A Multiple Protein Structural Alignment Algorithm.	WABI	2002	DBLP DOI BibTeX RDF
32	John H. Reif, Thomas H. LaBean, Nadrian C. Seeman	Challenges and Applications for Self-Assembled DNA Nanostructures.	DNA Computing	2000	DBLP DOI BibTeX RDF
32	James C. Ellenbogen	Advances Toward Molecular-Scale Electronic Digital Logic Circuits: A Review and Prospectus.	Great Lakes Symposium on VLSI	1999	DBLP DOI BibTeX RDF	nanocomputer architectures, molecular circuit designs, molecular adder, nanoelectronics, molecular electronics
30	Kenichi Fujibayashi, David Yu Zhang, Erik Winfree, Satoshi Murata	Error suppression mechanisms for DNA tile self-assembly and their simulation.	Nat. Comput.	2009	DBLP DOI BibTeX RDF	Algorithmic self-assembly, Assembly errors, Branch migration, Protecting molecules, DNA self-assembly
30	Johannes W. Kruisselbrink, Alexander Aleman, Michael T. M. Emmerich, Adriaan P. IJzerman, Andreas Bender 0002, Thomas Bäck, Eelke van der Horst	Enhancing search space diversity in multi-objective evolutionary drug molecule design using niching.	GECCO	2009	DBLP DOI BibTeX RDF	evolutionary algorithms, drug design, molecules
30	Alessandra Carbone, Chengde Mao, Pamela E. Constantinou, Baoquan Ding, Jens Kopatsch, William B. Sherman, Nadrian C. Seeman	3D Fractal DNA Assembly from Coding, Geometry and Protection.	Nat. Comput.	2004	DBLP DOI BibTeX RDF	coding of times, DNA 3D assembly, DNA protection, geometry of tiles, Sierpinski cube, tiling, DNA nanotechnology, DNA molecules
30	Andy Brown, Steve Pettifer, Robert Stevens 0001	Evaluation of a non-visual molecule browser.	ASSETS	2004	DBLP DOI BibTeX RDF	connection browsing, hierarchical browsing, graphs, browsing, molecules, non-visual, synthetic speech
30	Maria Emília Telles Walter, Zanoni Dias, João Meidanis	A New Approach for Approximating the Tranposition Distance.	SPIRE	2000	DBLP DOI BibTeX RDF	transposition distance approximation, genome comparison, rearrangement distance, rearrangement events, relative gene order, similar genes, linear gene orders, breakpoint diagram, approximation algorithm, data structures, permutations, DNA, C programming language, DNA molecules
30	Max H. Garzon, Evan M. Drumwright, Russell J. Deaton, David Renault	Virtual Test Tubes: A New Methodology for Computing.	SPIRE	2000	DBLP DOI BibTeX RDF	biocomputers, virtual test tubes, biological molecules, electronic computers, biomolecules, solid-state based computers, Edna, reliability, evolutionary algorithms, computing methodology, biomolecular computing
30	Peter D. Lauren, N. Nandhakumar	Recovering the viewing parameters of random, translated and noisy projections of asymmetric objects.	CVPR	1996	DBLP DOI BibTeX RDF	noisy projections, translated projections, randomly acquired projections, asymmetric objects, common lines algorithm, three-dimensional Fourier space, translational displacement, in vivo images, underwater scenes, radioastronomy, geoseismic analysis, portable radiography, industrial inspection, image reconstruction, Fourier transforms, Fourier transforms, intersection, cells, random projections, viruses, three-dimensional reconstruction, molecules
30	Herbert Edelsbrunner, Michael A. Facello, Ping Fu, Jie Liang	Measuring proteins and voids in proteins.	HICSS (5)	1995	DBLP DOI BibTeX RDF	protein voids, space filling diagram, solvent accessible surface, metric properties, empty space, surface area contributions, 3-dimensional alpha complexes, inclusion-exclusion formulas, three dimensional alpha complexes, computational geometry, geometric models, diagrams, biology computing, proteins, proteins, chemistry, volume, chemistry computing, molecular surface, molecules, surface area
30	A. V. Dzyabchenko, Valery N. Agafonov	Computer-aided design of crystalline drugs.	HICSS (5)	1995	DBLP DOI BibTeX RDF	crystal structure, crystalline drugs, crystal structure prediction, minimum-energy packings, observed space-group occurrence factors, crystal symmetry, multidimensional crystal-structure parameter space, cell parameters, rigid-body molecular parameters, accelerated convergence method, lattice energy, multi-step structure optimization technique, Packing of Molecules in Crystal, PMC program, implicit symmetry, CRYCOM, crystal comparison program, computational study, crystal structure polymorphism piracetam, metastable form, searching, CAD, computer-aided design, optimisation, polymorphism, chemistry, chemistry computing, search region
28	Carlos Armando García, Roberto Therón, Rafael Peláez, José Luis López-Pérez, Gustavo Santos-García	Visual Evaluation of Clustered Molecules in the Process of New Drugs Design.	Smart Graphics	2009	DBLP DOI BibTeX RDF	clustering, information visualization, drug design, virtual screening, visual analysis, tubulin
28	Luca Cardelli	Molecules as Automata.	WADT	2008	DBLP DOI BibTeX RDF
28	Luca Cardelli	Molecules as Automata.	CSL	2008	DBLP DOI BibTeX RDF
28	Yoshiki Yamaguchi, Tsutomu Maruyama, Ryuzo Azuma, Moritoshi Yasunaga, Akihiko Konagaya	Mesoscopic-level Simulation of Dynamics and Interactions of Biological Molecules Using Monte Carlo Simulation.	J. VLSI Signal Process.	2007	DBLP DOI BibTeX RDF	signal transduction pathways, FPGA, Monte Carlo simulation
28	Pooja M. Panchmatia, Biplab Sanyal, Peter M. Oppeneer	Ab Initio Calculations of the Electronic Structure and Magnetism of Iron Porphyrin-Type Molecules: A Benchmarking Study.	PARA	2006	DBLP DOI BibTeX RDF
28	Ryuzo Azuma, Tetsuji Kitagawa, Hiroshi Kobayashi, Akihiko Konagaya	Particle Simulation Approach for Sub-cellular Dynamics and Interactions of Biological Molecules.	IMSCCS (1)	2006	DBLP DOI BibTeX RDF
28	Angèle Tijou, Emmanuelle Richard, Paul Richard	Using Olfactive Virtual Environments for Learning Organic Molecules.	Edutainment	2006	DBLP DOI BibTeX RDF
28	Quan Wen 0001, Jean Gao, Akio Kosaka, Hidekazu Iwaki, Kate Luby-Phelps, Dorothy Mundy	A particle filter framework using optimal importance function for protein molecules tracking.	ICIP (1)	2005	DBLP DOI BibTeX RDF
28	Eric-Wubbo Lameijer, Adriaan P. IJzerman, Joost N. Kok	The molecule evoluator: an interactive evolutionary algorithm for designing drug molecules.	GECCO	2005	DBLP DOI BibTeX RDF	drug design, interactive evolution, molecule
28	Scott S. Hampton, Jesús A. Izaguirre	Improved Sampling for Biological Molecules Using Shadow Hybrid Monte Carlo.	International Conference on Computational Science	2004	DBLP DOI BibTeX RDF
28	Hiroki Uejima, Masami Hagiya	Analyzing Secondary Structure Transition Paths of DNA/RNA Molecules.	DNA	2003	DBLP DOI BibTeX RDF
28	Christian Borgelt, Michael R. Berthold	Mining Molecular Fragments: Finding Relevant Substructures of Molecules.	ICDM	2002	DBLP DOI BibTeX RDF
28	Hee-Woong Lim, Ji-Eun Yun, Hae-Man Jang, Young-Gyu Chai, Suk-In Yoo, Byoung-Tak Zhang	Version Space Learning with DNA Molecules.	DNA	2002	DBLP DOI BibTeX RDF
28	Hubert Hug, Rainer Schuler	Implementation of a Random Walk Method for Solving 3-SAT on Circular DNA Molecules.	DNA	2002	DBLP DOI BibTeX RDF
28	Minoru Kanehisa	Sequence comparison to graph comparison--a new generation of algorithms for network analysis of interacting molecules (abstract only).	RECOMB	2000	DBLP DOI BibTeX RDF
25	Jack Hellerstedt, Ales Cahlík, Martin Svec, Oleksandr Stetsovych, Tyler Hennen	Counting Molecules: Python based scheme for automated enumeration and categorization of molecules in scanning tunneling microscopy images.	CoRR	2022	DBLP DOI BibTeX RDF
25	Jack Hellerstedt, Ales Cahlík, Martin Svec, Oleksandr Stetsovych, Tyler Hennen	Counting molecules: Python based scheme for automated enumeration and categorization of molecules in scanning tunneling microscopy images.	Softw. Impacts	2022	DBLP DOI BibTeX RDF
25	Balint Dudas	Molecular mechanisms of phase II metabolizing enzymes and ABC transporters, and their interactions with small molecules modeled through structure-based and machine learning methods. (Mécanismes moléculaires des enzymes de métabolisme de phase II et des transporteurs ABC, et leurs interactions avec de petites molécules modélisées par des méthodes structurales et d'apprentissage automatique).		2022	RDF
25	Marylène Rugard	Compréhension des effets biologiques de molécules odorantes à l'aide d'outils computationnels et de réseaux biologiques. (Understanding the biological effects of odorant molecules using computational tools and biological networks).		2022	RDF
25	Vikrant Tripathy, Arjun Saha, Krishnan Raghavachari	Electrostatically embedded molecules-in-molecules approach and its application to molecular clusters.	J. Comput. Chem.	2021	DBLP DOI BibTeX RDF
25	Amit Gupta, Sabyasachi Chakraborty, Raghunathan Ramakrishnan	Revving up 13C NMR shielding predictions across chemical space: benchmarks for atoms-in-molecules kernel machine learning with new data for 134 kilo molecules.	Mach. Learn. Sci. Technol.	2021	DBLP DOI BibTeX RDF
25	Maria Kadukova	Development of novel algorithms for data-driven prediction of interactions between proteins and small molecules. (Développement de nouveaux modèles, basés sur les données, pour prédire les interactions entre protéines et petites molécules).		2021	RDF
25	Ophélie Lo-Thong-Viramoutou	Modélisation de voies métaboliques pour la production de molécules. (Metabolic pathways modeling for the production of molecules).		2021	RDF
25	Bishnu Thapa, Jon Erickson, Krishnan Raghavachari	Quantum Mechanical Investigation of Three-Dimensional Activity Cliffs Using the Molecules-in-Molecules Fragmentation-Based Method.	J. Chem. Inf. Model.	2020	DBLP DOI BibTeX RDF
25	Stéfi Nouleho	Algorithmique de graphes pour la similarité structurelle de molécules et de réactions. (Graph algorithms for structural similarity of molecules and reactions).		2020	RDF
25	Sarkis Halladjian	Spatially Integrated Abstraction of Genetic Molecules. (Abstraction spatiale intégrée de molécules génétiques).		2020	RDF
25	Bishnu Thapa, Krishnan Raghavachari	Energy Decomposition Analysis of Protein-Ligand Interactions Using Molecules-in-Molecules Fragmentation-Based Method.	J. Chem. Inf. Model.	2019	DBLP DOI BibTeX RDF
25	Cong Anh Khanh Le	Inclusion complexes of amylose: morphogenesis, crystal structure and release of bioactive molecules. (Complexes d'inclusion de l'amylose: morphogenèse, structure cristalline et relargage de molécules bioactives).		2018	RDF
25	Mélanie Boudard	Prédiction de structure tridimensionnelle de molécules d'ARN par minimisation de regret. (Prediction of three-dimensional structure of RNA molecules by regret minimization).		2016	RDF
25	Eva Nittinger, Nadine Schneider, Gudrun Lange, Matthias Rarey	Evidence of Water Molecules - A Statistical Evaluation of Water Molecules Based on Electron Density.	J. Chem. Inf. Model.	2015	DBLP DOI BibTeX RDF
25	Bo Ding, Nan Li, Wei Wang 0051	Characterizing Binding of Small Molecules. II. Evaluating the Potency of Small Molecules to Combat Resistance Based on Docking Structures.	J. Chem. Inf. Model.	2013	DBLP DOI BibTeX RDF
25	Nicolas Lafitte	Modeling and control of MEMS tweezers for the characterizations of enzymatic reactions on DNA molecules. (Caractérisation et commande de micropince en silicium pour l'amélioration de la sensibilité paramétrique d'expériences biologiques sur des molécules d'ADN).		2012	RDF
25	Leo Ghemtio	Simulation numérique et approche orientée connaissance pour la découverte de nouvelles molécules thérapeutiques. (Numeric simulation and knowledge-oriented approach for the discovery of new therapeutic molecules).		2010	RDF
25	Léo Aymar Ghemtio Wafo	Simulation numérique et approche orientée connaissance pour la découverte de nouvelles molécules thérapeutiques. (Numeric simulation and knowledge-oriented approach for the discovery of new therapeutic molecules).		2010	RDF
25	Zak E. Hughes, Lorna M. Stimson, Henk Slim, Juho S. Lintuvuori, Jaroslav M. Ilnytskyi, Mark R. Wilson 0001	An investigation of soft-core potentials for the simulation of mesogenic molecules and molecules composed of rigid and flexible segments.	Comput. Phys. Commun.	2008	DBLP DOI BibTeX RDF
25	Shuzo Yoshioki	Dynamics of a protein and water molecules surrounding the protein: Hydrogen-bonding between vibrating water molecules and a fluctuating protein.	J. Comput. Chem.	2002	DBLP DOI BibTeX RDF
24	Rezaul Alam Chowdhury, Chandrajit L. Bajaj	Multi-level grid algorithms for faster molecular energetics.	Symposium on Solid and Physical Modeling	2010	DBLP DOI BibTeX RDF
24	Samir M. Iqbal, Rashid Bashir	Nanoelectronic-Based Detection for Biology and Medicine.	Handbook of Automation	2009	DBLP DOI BibTeX RDF
24	Olga Sourina, Jaume Torres, Jing Wang	Visual Haptic-Based Biomolecular Docking and Its Applications in E-Learning.	Trans. Edutainment	2009	DBLP DOI BibTeX RDF	biomolecular docking, e-learning, virtual environments, Haptic interfaces, molecular visualization
24	Jianmin Ma, Minh Ngoc Nguyen 0002, Jagath C. Rajapakse	Gene Classification Using Codon Usage and Support Vector Machines.	IEEE ACM Trans. Comput. Biol. Bioinform.	2009	DBLP DOI BibTeX RDF	codon usage bias, gene classification, Human Leukocyte Antigen (HLA), Major Histocompatibility Complex (MHC), Relative Synonymous Codon Use (RSCU) frequency, Cluster analysis
24	Aude Bolopion, Barthelemy Cagneau, Stephane Redon, Stephane Régnier	Haptic feedback for molecular simulation.	IROS	2009	DBLP DOI BibTeX RDF
24	Ján Manuch, Ladislav Stacho, Christine Stoll	Two lower bounds for self-assemblies at temperature 1.	SAC	2009	DBLP DOI BibTeX RDF
24	Nicolay Postarnakevich, Rahul Singh	Global-to-local representation and visualization of molecular surfaces using deformable models.	SAC	2009	DBLP DOI BibTeX RDF	surface mapping, deformable models, molecular visualization, molecular surfaces