Articles
Page 34 of 38
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Citation: Chemistry Central Journal 2009 3(Suppl 1):P77
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Modelling of complex multicellular systems: tumour-immune cells competition
Citation: Chemistry Central Journal 2009 3(Suppl 1):P75 -
Optimization of in silicogenerated ligand geometries within a binding pocket using drugscore potentials
Citation: Chemistry Central Journal 2009 3(Suppl 1):P73 -
Online chemical modeling environment
Citation: Chemistry Central Journal 2009 3(Suppl 1):P71 -
Frequent substructure mining of GPCR ligands
Citation: Chemistry Central Journal 2009 3(Suppl 1):P69 -
PhAST: pharmacophore alignment search tool
Citation: Chemistry Central Journal 2009 3(Suppl 1):P67 -
Validation of predicitve modelling techniques in drug design – influence of test set composition
Citation: Chemistry Central Journal 2009 3(Suppl 1):P64 -
Components for computer-assisted structure elucidation
Citation: Chemistry Central Journal 2009 3(Suppl 1):P62 -
Theoretical structural metabolomics
Citation: Chemistry Central Journal 2009 3(Suppl 1):P60 -
Modeling of inclusion complexes of amylose and synthetical polymers
Citation: Chemistry Central Journal 2009 3(Suppl 1):P58 -
Evaluation of the performance of 3D virtual screening programs: docking vs. structure-based pharmacophore
Citation: Chemistry Central Journal 2009 3(Suppl 1):P56 -
From fast light-activated processes in biomolecules to large-scale aggregation of membrane proteins: molecular dynamics simulations at different time and length scales
Citation: Chemistry Central Journal 2009 3(Suppl 1):P54 -
Protein structure calculation with a max-min ant system
Citation: Chemistry Central Journal 2009 3(Suppl 1):P52 -
A theoretical investigation of microhydration of cationic amino acids
Citation: Chemistry Central Journal 2009 3(Suppl 1):P50 -
Computation of accurate redox potentials for Fe, Mn and Ni model complexes
Citation: Chemistry Central Journal 2009 3(Suppl 1):P48 -
Carbon-Hydrogen bond activation
Citation: Chemistry Central Journal 2009 3(Suppl 1):P46 -
Similarity-based virtual screening using bayesian inference network
Citation: Chemistry Central Journal 2009 3(Suppl 1):P44 -
Creating chemo- and bioinformatics workflows, further developments within the CDK-Taverna Project
Citation: Chemistry Central Journal 2009 3(Suppl 1):P42 -
Chemical complexity mapping in QSAR models
Citation: Chemistry Central Journal 2009 3(Suppl 1):P40 -
Molecular descriptors based on entropy and the full topological neighborhood of all atoms
Citation: Chemistry Central Journal 2009 3(Suppl 1):P38 -
Chemoinformatics of ionic liquids and solids
Citation: Chemistry Central Journal 2009 3(Suppl 1):P36 -
Emerging trends of nanomanufacturing by CVD method and electrical properties of CNT
Citation: Chemistry Central Journal 2009 3(Suppl 1):P34 -
MolWind – mapping molecule spaces to geospatial worlds
Citation: Chemistry Central Journal 2009 3(Suppl 1):P32 -
A benchmark data set for in silico prediction of ames mutagenicity
Citation: Chemistry Central Journal 2009 3(Suppl 1):P31 -
Distance phenomena in high-dimensional chemical descriptor spaces: consequences for similarity-based approaches
Citation: Chemistry Central Journal 2009 3(Suppl 1):P28 -
Sublinear ligand-based virtual screening using bitmap indices
Citation: Chemistry Central Journal 2009 3(Suppl 1):P27 -
Additive inductive learning in QSAR/QSPR studies and molecular modeling
Citation: Chemistry Central Journal 2009 3(Suppl 1):P25 -
Modelling the multi-target selectivity: o-phosphorylated oximes as serine hydrolase inhibitors
Citation: Chemistry Central Journal 2009 3(Suppl 1):P23 -
Combined quantum mechanical and molecular mechanical methods to study chemical events in complex biological environments
Citation: Chemistry Central Journal 2009 3(Suppl 1):O21 -
XFb – a combined approach for 2D ring drawing
Citation: Chemistry Central Journal 2009 3(Suppl 1):P21 -
Fast and accurate method for flexible ligand superposition and shapebased screening
Citation: Chemistry Central Journal 2009 3(Suppl 1):O19 -
Distance-dependent: characterizing virtual screening datasets
Citation: Chemistry Central Journal 2009 3(Suppl 1):P19 -
Detection, analysis, and visualization of relevant scaffolds in medicinal chemistry project databases
Citation: Chemistry Central Journal 2009 3(Suppl 1):O17 -
MUVing SAFEly: Scale for Assessing Figures of Effectiveness (SAFE) in virtual screening using Maximum Unbiased Validation (MUV) datasets
Citation: Chemistry Central Journal 2009 3(Suppl 1):P17 -
Open access: does it address our problems?
Citation: Chemistry Central Journal 2009 3(Suppl 1):O15 -
Crystal structures of moderately complex organic molecules are predictable
Citation: Chemistry Central Journal 2009 3(Suppl 1):O13 -
Two-step hierarchical assignments on molecular graphs
Citation: Chemistry Central Journal 2009 3(Suppl 1):P13 -
Incorporating molecular flexibility into three-dimensional structural kernels
Citation: Chemistry Central Journal 2009 3(Suppl 1):O11 -
An extension of the pharmacophore kernel using radial atomtype fingerprints
Citation: Chemistry Central Journal 2009 3(Suppl 1):P11 -
Web-based computational chemistry
Citation: Chemistry Central Journal 2009 3(Suppl 1):P9 -
Graph representation of molecular datasets: applications to dataset visualization and comparison using graph indices
Citation: Chemistry Central Journal 2009 3(Suppl 1):O9 -
A detailed aanalysis of diphosphate binding sites in proteins
Citation: Chemistry Central Journal 2009 3(Suppl 1):P7 -
Calculation of molecular lipophilicity: state of the art and comparison of methods on more than 96000 compounds
Citation: Chemistry Central Journal 2009 3(Suppl 1):O7 -
Complexity effects in fingerprint similarity searching
Citation: Chemistry Central Journal 2009 3(Suppl 1):P5 -
Explorative Data Analysis: from machine learning to discovery support systems
Citation: Chemistry Central Journal 2009 3(Suppl 1):O5 -
Assessment of complex SARs using Formal Concept Analysis of fragment combinations
Citation: Chemistry Central Journal 2009 3(Suppl 1):P3 -
New open drug activity data at EBI
Citation: Chemistry Central Journal 2009 3(Suppl 1):O3 -
4th German Conference on Chemoinformatics: 22. CIC-Workshop. November 9–11, 2008, Goslar, Germany
Citation: Chemistry Central Journal 2009 3(Suppl 1):I1 -
Unlocking stereochemical diversity
Citation: Chemistry Central Journal 2009 3(Suppl 1):P1 -
Classification and characterization of materials – from archaeometry to comets
Citation: Chemistry Central Journal 2009 3(Suppl 1):O1
Annual Journal Metrics
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2022 Citation Impact
4.6 - 2-year Impact Factor
4.4 - 5-year Impact Factor
1.285 - SNIP (Source Normalized Impact per Paper)
0.607 - SJR (SCImago Journal Rank)2023 Speed
23 days submission to first editorial decision for all manuscripts (Median)
151 days submission to accept (Median)2023 Usage
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