ProBiS-Dock: A Hybrid Multitemplate Homology Flexible Docking Algorithm Enabled by Protein Binding Site Comparison | 0 | 0.34 | 2022 |
Discovery of Novel Potential Human Targets of Resveratrol by Inverse Molecular Docking. | 0 | 0.34 | 2019 |
BoBER: web interface to the base of bioisosterically exchangeable replacements. | 1 | 0.48 | 2017 |
GenProBiS: web server for mapping of sequence variants to protein binding sites. | 1 | 0.41 | 2017 |
H274Y's Effect on Oseltamivir Resistance: What Happens Before the Drug Enters the Binding Site. | 1 | 0.36 | 2016 |
LiSiCA: A Software for Ligand-Based Virtual Screening and Its Application for the Discovery of Butyrylcholinesterase Inhibitors. | 2 | 0.40 | 2015 |
Modeling enzyme-ligand binding in drug discovery | 1 | 0.37 | 2015 |
ProBiS-CHARMMing: Web Interface for Prediction and Optimization of Ligands in Protein Binding Sites. | 1 | 0.41 | 2015 |
Structure-based function prediction of uncharacterized protein using binding sites comparison. | 1 | 0.35 | 2013 |
Structurally Conserved Binding Sites of Hemagglutinin as Targets for Influenza Drug and Vaccine Development. | 2 | 0.38 | 2013 |
Exact Parallel Maximum Clique Algorithm for General and Protein Graphs. | 18 | 0.72 | 2013 |
Parallel-Probis: Fast Parallel Algorithm For Local Structural Comparison Of Protein Structures And Binding Sites | 2 | 0.42 | 2012 |
Correlating Protein Hot Spot Surface Analysis Using ProBiS with Simulated Free Energies of Protein-Protein Interfacial Residues. | 3 | 0.41 | 2012 |
Probis-2012: Web Server And Web Services For Detection Of Structurally Similar Binding Sites In Proteins | 16 | 0.71 | 2012 |
ProBiS-Database: Precalculated Binding Site Similarities and Local Pairwise Alignments of PDB Structures. | 10 | 0.56 | 2012 |
The Distributed Diagonal Force Decomposition Method For Parallelizing Molecular Dynamics Simulations | 2 | 0.40 | 2011 |
Probis: A Web Server For Detection Of Structurally Similar Protein Binding Sites | 29 | 1.22 | 2010 |
Protein-Protein Binding Site Prediction by Local Structural Alignment. | 7 | 0.53 | 2010 |
New all-atom force field for molecular dynamics simulation of an AlPO4-34 molecular sieve | 1 | 0.74 | 2008 |
Cluj and Related Polynomials Applied in Correlating Studies. | 1 | 0.45 | 2007 |
Protein-Protein Binding-Sites Prediction by Protein Surface Structure Conservation. | 14 | 1.02 | 2007 |
Retro-Leapfrog and Related Retro Map Operations | 1 | 0.41 | 2006 |
New force field for calcium binding sites in annexin-membrane complexes. | 1 | 0.50 | 2006 |
The Regional Biophysics Meeting March 16-20, 2005, Zrece, Slovenia | 0 | 0.34 | 2005 |
Molecular dynamics integration meets standard theory of molecular vibrations. | 4 | 0.85 | 2005 |
Symplectic Molecular Dynamics Simulations on Specially Designed Parallel Computers. | 4 | 0.86 | 2005 |
Periodic Cages | 0 | 0.34 | 2005 |
The Eighteenth International Course & Conference on the Interfaces among Mathematics, Chemistry & Computer Sciences June 23-28, 2003 Dubrovnik, Croatia | 0 | 0.34 | 2004 |
Reviews in Computational Chemistry. Volume 19 Edited by Kenny B. Lipkowitz, Raima Larter, and Thomas R. Cundari. Wiley-VCH 2003, ISBN 0-471-23585-7 | 0 | 0.34 | 2004 |
Improving the Performance of Molecular Dynamics Simulations on Parallel Clusters. | 3 | 0.78 | 2004 |
Enumeration of conjugated circuits in nanotubes. | 1 | 0.38 | 2004 |
Molecular dynamics integration time step dependence of the split integration symplectic method on system density. | 1 | 0.48 | 2003 |
The Complexity of Parallel Symplectic Molecular Dynamics Algorithms | 2 | 0.42 | 1997 |
Split Integration Symplectic Method for Molecular Dynamics Integration | 3 | 0.48 | 1997 |
Comparison Of Parallel Verlet And Implicit Runge-Kutta Methods For Molecular-Dynamics Integration | 2 | 0.41 | 1995 |
An Efficient Symplectic Integration Algorithm For Molecular-Dynamics Simulations | 6 | 0.95 | 1995 |
Harmonic Analysis of Large Systems. III. Comparison with Molecular Dynamics. | 11 | 1.79 | 1995 |
Harmonic Analysis of Large Systems. I. Methodology | 33 | 9.51 | 1995 |
Harmonic Analysis of Large Systems. II. Comaprison of Different Protein Models | 6 | 0.85 | 1995 |
Parallelization of an Implicit Runge-Kutta Method for Molecular Dynamics Integration | 5 | 1.07 | 1994 |
Implicit Runge-Kutta method for molecular dynamics integration | 9 | 2.64 | 1993 |