Looking for homochirality in the inter-stellar medium G. MarloieM. LattelaisY. Ellinger OriginalPaper 28 January 2010 Pages: 48 - 56
Effect of the Enhanced Cyan Fluorescent Protein framework on the UV/visible absorption spectra of some chromophores Adèle D. LaurentXavier Assfeld OriginalPaper 28 January 2010 Pages: 38 - 47
Estimates of ligand-binding affinities supported by quantum mechanical methods Pär SöderhjelmJacob KongstedUlf Ryde OriginalPaper 28 January 2010 Pages: 21 - 37
Na+, K+ and Tl+ hydration from QM/MM computations and MD simulations with a polarizable force field Bogdan B. LevDennis R. SalahubSergei Yu Noskov OriginalPaper 28 January 2010 Pages: 12 - 20
Study of the docking of competitive inhibitors at a model of tyrosinase active site: Insights from joint broken-symmetry/spin-flip DFT computations and ELF topological analysis A. de la LandeJ. MaddalunoJ. -P. Piquemal OriginalPaper 28 January 2010 Pages: 3 - 11
Editorial: Special issue on quantum mechanical modeling of biological systems Jean-Philip PiquemalDennis Salahub EditorialNotes 28 January 2010 Pages: 1 - 2
Structural basis for the resilience of Darunavir (TMC114) resistance major flap mutations of HIV-1 protease Rituraj PurohitRao Sethumadhavan OriginalPaper 14 November 2009 Pages: 320 - 328
Two multi-classification strategies used on SVM to predict protein structural classes by using auto covariance Jiang WuYi-Zhou LiLe-Zheng Yu OriginalPaper 14 November 2009 Pages: 315 - 319
Study of the adsorption step in the oxidative dehydrogenation of propane on V2O5 (001) using calculations of electronic density of states Ngoc Ha NguyenTran Thanh HueMinh Tho Nguyen OriginalPaper 14 November 2009 Pages: 308 - 314
Rationale for cross-species infection and cross-subtype mutation in hemagglutinins from influenza A virus Shao-Min YanGuang Wu OriginalPaper 14 November 2009 Pages: 303 - 307
High throughput prediction and analysis of small interfering RNA from the 5′UTR and capsid genes of flavivirus through in silico strategies Pallavi SomvanshiVijai SinghP. K. Seth OriginalPaper 14 November 2009 Pages: 298 - 302
In Silico identification of catalytic residues in azobenzene reductase from bacillus subtilis and its docking studies with azo dyes K. RamanathanV. ShanthiRao Sethumadhavan OriginalPaper 14 November 2009 Pages: 290 - 297
Finger-vein image recognition combining modified Hausdorff distance with minutiae feature matching Cheng-Bo YuHua-Feng QinXiao-Qian Hu OriginalPaper 14 November 2009 Pages: 280 - 289
Trends in global warming and evolution of matrix protein 2 family from influenza A virus Shao-Min YanGuang Wu OriginalPaper 14 November 2009 Pages: 272 - 279
Contribution of unconventional C-H…O bonds to the structural stability of Antimicrobial peptides K. RamanathanV. ShanthiRao Sethumadhavan OriginalPaper 14 November 2009 Pages: 263 - 271
Computational modeling study of human nicotinic acetylcholine receptor for developing new drugs in the treatment of alcoholism Zeng-Jian HuLi BaiWilliam Southerland OriginalPaper 14 November 2009 Pages: 254 - 262
Electromagnetic detection of HIV DNA in the blood of AIDS patients treated by antiretroviral therapy Luc MontagnierJamal AïssaHenri Chenal OriginalPaper 14 November 2009 Pages: 245 - 253
A simple method based on multiple alignment and phylogeny to derive a correlation between the protein fold and sequence via motif search Syed Baquer RizviAnil Kumar ShuklaVikash Kumar Dubey OriginalPaper 07 August 2009 Pages: 235 - 243
Research of the ATPase’s rotation catalysis stochastic transition dynamics Yan ZhengMing-Jian YangYan-Bin Huang OriginalPaper 07 August 2009 Pages: 229 - 234
Computational and structural analysis of deleterious functional SNPs in ARNT oncogene C. George Priya DossRao Sethumadhavan OriginalPaper 07 August 2009 Pages: 220 - 228
Structural flexibility and interactions of PTP1B’s S-loop Jing-Fang WangKe GongYi-Xue Li OriginalPaper 07 August 2009 Pages: 214 - 219
Theoretical analysis of the relationship between positive/negative cooperativity and enzyme activation/inhibition Hao GeMin Qian OriginalPaper 07 August 2009 Pages: 204 - 213
First-principle conformational analysis of glycine residues in the αβ-tubulin dimer Gang YangCheng XingYuan-Gang Zu OriginalPaper 07 August 2009 Pages: 196 - 203
Parallel algorithm research on several important open problems in bioinformatics Bei-Fang NiuXian-Yu LangXue-Bin Chi OriginalPaper 07 August 2009 Pages: 187 - 195
Text mining biomedical literature for constructing gene regulatory networks Yong-Ling SongSu-Shing Chen OriginalPaper 07 August 2009 Pages: 179 - 186
Application of Kohonen maps for solving the classification puzzle in AGC kinase protein sequences U.S.N MurtyAmit Kumar BanerjeeNeelima Arora OriginalPaper 07 August 2009 Pages: 173 - 178
Structural Modeling of the NS 3 helicase of Tick-borne encephalitis virus and their virtual screening of potent drugs using molecular docking Vijai SinghPallavi Somvanshi OriginalPaper 07 August 2009 Pages: 168 - 172
Displacement matrix elements of Deng-Fan oscillators Zimei RongMartin L. Sage OriginalPaper 02 June 2009 Pages: 163 - 167
Cross-talks of sensory transcription networks in response to various environmental stresses Ting ChenFeng LiBor-Sen Chen Erratum 07 November 2009 Pages: 162 - 162
Attractive energy and entropy or particle size: the Yin and Yang of physical and biological science Douglas Henderson Erratum 27 October 2009 Pages: 161 - 161
Molecular thermodynamics of trifluoroethanol-induced helix formation: analysis of the solvation structure and free energy by the 3D-RISM theory Takashi ImaiAndriy KovalenkoAkinori Kidera OriginalPaper 28 May 2009 Pages: 156 - 160
A semi-supervised learning based method: Laplacian support vector machine used in diabetes disease diagnosis Jiang WuYuan-Bo DiaoDai-Chuan Ma OriginalPaper 28 May 2009 Pages: 151 - 155
Genome-wide analysis of microsatellite sequence in seven filamentous fungi Cheng-Yun LiLin LiuYou-Yong Zhu OriginalPaper 28 May 2009 Pages: 141 - 150
Radicals as hydrogen bond donors and acceptors Erin R. JohnsonGino A. Dilabio OriginalPaper 28 May 2009 Pages: 133 - 140
The gramicidin channel ion permeation free-energy profile: Direct and indirect effects of CHARMM force field improvements Morad MustafaDavid D. Busath OriginalPaper 28 May 2009 Pages: 113 - 127
Effects of C-Termini distribution on ion transport along microtubules P. W. ChelminiakJ. A. TuszyńskiJ.M. Dixon OriginalPaper 28 May 2009 Pages: 108 - 112
Electromagnetic signals are produced by aqueous nanostructures derived from bacterial DNA sequences Luc MontagnierJamal AïssaClaude Lavalléee OriginalPaper 04 March 2009 Pages: 81 - 90
Evaluation of similarity measures for gene expression data and their correspondent combined measures Gang-Guo LiZheng-Zhi Wang OriginalPaper 10 June 2009 Pages: 72 - 80
MDAS: An integrated system for metabonomic data analysis Juan LiuBo LiJiang-Hui Xiong OriginalPaper 10 June 2009 Pages: 61 - 71
Importance of lone pair interactions/redistribution in hard and soft ligands within the active site of alcohol dehydrogenase Zn-metalloenzyme: Insights from electron localization function B. De CourcyN. GreshJ.-P. Piquemal OriginalPaper 10 June 2009 Pages: 55 - 60
Cross-talks of sensory transcription networks in response to various environmental stresses Ting ChenFeng LiBor-Sen Chen OriginalPaper 27 October 2009 Pages: 46 - 54
Effect of the quality of the interaction data on predicting protein function from protein-protein interactions Qing-Shan NiZheng-Zhi WangYing-Jie Zhao OriginalPaper 10 June 2009 Pages: 40 - 45
Evaluation of water quality in Er-longshan reservoir by fuzzy model Ying ZhangChun-Hui FanXin Bai OriginalPaper 10 June 2009 Pages: 30 - 39
Mutation effects on structural stability of polyglutamine peptides by molecular dynamics simulation Miki NakanoHirofumi WatanabeShigenori Tanaka OriginalPaper 10 June 2009 Pages: 21 - 29
A peptide-linkage deletion procedure for estimate of energetic contributions of individual peptide groups in a complex environment: Application to parallel β-Sheets Haobo GuoAndrey GorinHong Guo OriginalPaper 10 June 2009 Pages: 12 - 20
Attractive energy and entropy or particle size: the yin and yang of physical and biological science Douglas Henderson OriginalPaper 27 October 2009 Pages: 1 - 11
Computational approach towards finding evolutionary distance and gene order using promoter sequences of central metabolic pathway Meera ALalitha RangarajanSavithri Bhat OriginalPaper 19 February 2009 Pages: 128 - 132
Suitable basis sets for accurate NMR chemical shift calculations: an application to in vivo studies of benzothiazole metabolites Philip E. Hoggan OriginalPaper 19 February 2009 Pages: 99 - 107
Exploring the molecular origin of the high selectivity of multisubunit RNA polymerases by stochastic kinetic models Rui ZhuAurélien de la LandeDennis R. Salahub OriginalPaper 19 February 2009 Pages: 91 - 98
