Articles
Page 32 of 35
-
Citation: Chemistry Central Journal 2009 3(Suppl 1):P76
-
Pseudoreceptor-based pocket selection in a molecular dynamics simulation of the histamine H4 receptor
Citation: Chemistry Central Journal 2009 3(Suppl 1):P74 -
CELLmicrocosmos 2.1: a software approach for the modelling of three-dimensional PDB membranes
Citation: Chemistry Central Journal 2009 3(Suppl 1):P72 -
An online-system for the evaluation of hazardous substances
Citation: Chemistry Central Journal 2009 3(Suppl 1):P70 -
Virtual chemical reactions for drug design
Citation: Chemistry Central Journal 2009 3(Suppl 1):P68 -
PocketGraph: graph representation of binding site volumes
Citation: Chemistry Central Journal 2009 3(Suppl 1):P66 -
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 -
Modeling of inclusion complexes of amylose and synthetical polymers
Citation: Chemistry Central Journal 2009 3(Suppl 1):P58 -
Molecular modeling studies on dengue and West Nile Virus NS2B/NS3 protease inhibitor interaction
Citation: Chemistry Central Journal 2009 3(Suppl 1):P55 -
Multi-scale modelling of macromolecular conformational changes
Citation: Chemistry Central Journal 2009 3(Suppl 1):P53 -
Dissecting the mechanism of adenosine kinase inhibition: new insights for drug designing
Citation: Chemistry Central Journal 2009 3(Suppl 1):P51 -
Designing binding pockets on protein surfaces using the A* algorithm
Citation: Chemistry Central Journal 2009 3(Suppl 1):P49 -
A distance-based method for evaluating protein-structures
Citation: Chemistry Central Journal 2009 3(Suppl 1):P47 -
Glide XP fragment docking and structurebased pharmacophores
Citation: Chemistry Central Journal 2009 3(Suppl 1):P45 -
Crystallographic and theoretical investigation of interactions of water molecule with aryl ring
Citation: Chemistry Central Journal 2009 3(Suppl 1):P43 -
Personalised information spaces for chemical digital libraries
Citation: Chemistry Central Journal 2009 3(Suppl 1):P41 -
Implication of heteroatom tautomer in QSAR models
Citation: Chemistry Central Journal 2009 3(Suppl 1):P39 -
Comparison of some linear regression methods – available in R – for a QSPR problem
Citation: Chemistry Central Journal 2009 3(Suppl 1):P37 -
Reliability analysis of functional CNT
Citation: Chemistry Central Journal 2009 3(Suppl 1):P35 -
Atomistic modelling of ion aggregation from solution and the self-organization of nanocrystals and nanocomposite biomaterials
Citation: Chemistry Central Journal 2009 3(Suppl 1):P33 -
A benchmark data set for in silico prediction of ames mutagenicity
Citation: Chemistry Central Journal 2009 3(Suppl 1):P31 -
EAI-TupletScore, a pharmacophore and shape driven ligand-based de-novo design algorithm
Citation: Chemistry Central Journal 2009 3(Suppl 1):P29 -
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 -
Investigation on the reaction mechanism of ribonuclease enzymes
Citation: Chemistry Central Journal 2009 3(Suppl 1):O23 -
Modelling the multi-target selectivity: o-phosphorylated oximes as serine hydrolase inhibitors
Citation: Chemistry Central Journal 2009 3(Suppl 1):P23 -
Knowledge-driven multi-objective de novodrug design
Citation: Chemistry Central Journal 2009 3(Suppl 1):P22 -
Combined quantum mechanical and molecular mechanical methods to study chemical events in complex biological environments
Citation: Chemistry Central Journal 2009 3(Suppl 1):O21 -
Analyzing molecular landscapes using random walks and information theory
Citation: Chemistry Central Journal 2009 3(Suppl 1):P20 -
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 -
Incorporating QSPR in the enumeration of fragment space
Citation: Chemistry Central Journal 2009 3(Suppl 1):P18 -
Detection, analysis, and visualization of relevant scaffolds in medicinal chemistry project databases
Citation: Chemistry Central Journal 2009 3(Suppl 1):O17 -
New and improved features of the docking software PLANTS
Citation: Chemistry Central Journal 2009 3(Suppl 1):P16 -
Open access: does it address our problems?
Citation: Chemistry Central Journal 2009 3(Suppl 1):O15 -
The perfect fit? Balancing predictive power and computational complexity for an atomistic model as prerequisite for nano-scale simulations
Citation: Chemistry Central Journal 2009 3(Suppl 1):O14 -
Ligand protonation states and stereoisomers in virtual screening
Citation: Chemistry Central Journal 2009 3(Suppl 1):P14 -
Computational nanoscience
Citation: Chemistry Central Journal 2009 3(Suppl 1):O12 -
Visualisation and exploitation of the chemical space covered by patents
Citation: Chemistry Central Journal 2009 3(Suppl 1):P12 -
Efficient ant colony optimization algorithms for structure- and ligand-based drug design
Citation: Chemistry Central Journal 2009 3(Suppl 1):O10 -
Assessing the selectivity of serine proteases inhibitors using structural similarity
Citation: Chemistry Central Journal 2009 3(Suppl 1):P10 -
Web-based computational chemistry
Citation: Chemistry Central Journal 2009 3(Suppl 1):P9 -
A novel method for predicting ligand regioselectivity to metabolism by the CYP3A4 enzyme
Citation: Chemistry Central Journal 2009 3(Suppl 1):O8 -
A detailed aanalysis of diphosphate binding sites in proteins
Citation: Chemistry Central Journal 2009 3(Suppl 1):P7 -
A new approach to kernel based data analysis algorithms
Citation: Chemistry Central Journal 2009 3(Suppl 1):O6 -
Analysis of structure-selectivity relationships through single- or dual step selectivity searching using 2D molecular fingerprints
Citation: Chemistry Central Journal 2009 3(Suppl 1):P4 -
SQUIRRELnovo: de novo design of a PPARα agonist by bioisosteric replacement
Citation: Chemistry Central Journal 2009 3(Suppl 1):O4 -
Investigation of the incidence of "undesirable" molecular moieties for high-throughput screening compound libraries in marketed drug compounds
Citation: Chemistry Central Journal 2009 3(Suppl 1):P2 -
Systematic computational SAR analysis
Citation: Chemistry Central Journal 2009 3(Suppl 1):O2
Annual Journal Metrics
-
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)2022 Speed
19 days submission to first editorial decision for all manuscripts (Median)
98 days submission to accept (Median)2022 Usage
866,760 downloads
126 Altmetric mentionsTransparency and Openness
TOP Factor Score - 9