Relationship between structure and entropy contributions in an anthraquinone mercapto derivative Maciej RomanAgnieszka KaczorMalgorzata Baranska Original Paper 25 February 2010 Pages: 1549 - 1557
Many-body energies during proton transfer in an aqueous system Ajay ChaudhariGul Afroz MerajShyi-Long Lee Original Paper 27 February 2010 Pages: 1559 - 1566
Study of a structurally similar kappa opioid receptor agonist and antagonist pair by molecular dynamics simulations Michal KolinskiSlawomir Filipek Original Paper 27 February 2010 Pages: 1567 - 1576
Effects of the V82A and I54V mutations on the dynamics and ligand binding properties of HIV-1 protease Pia DiraufHeike MeiselbachHeinrich Sticht Original Paper 27 February 2010 Pages: 1577 - 1583
Pharmacophore mapping of arylamino-substituted benzo[b]thiophenes as free radical scavengers Indrani MitraAchintya SahaKunal Roy Original Paper 01 March 2010 Pages: 1585 - 1596
Docking and 3D-QSAR studies of diverse classes of human aromatase (CYP19) inhibitors Partha Pratim RoyKunal Roy Original Paper 01 March 2010 Pages: 1597 - 1616
Density functional study of oxygen vacancy formation and spin density distribution in octahedral ceria nanoparticles Talgat M. InerbaevSudipta SealArtëm E. Masunov Original Paper 02 March 2010 Pages: 1617 - 1623
Contribution of charged and polar residues for the formation of the E1–E2 heterodimer from Hepatitis C Virus Siti Azma JusohChristoph WelschVolkhard Helms Original Paper 02 March 2010 Pages: 1625 - 1637
Investigation on the micro-mechanisms of Al3+ interfering the reactivities of aspartic acid and its biological processes with Mg2+ Jian Fen FanLiang Jun HeMin Tang Original Paper 02 March 2010 Pages: 1639 - 1650
In silico point mutation and evolutionary trace analysis applied to nicotinic acetylcholine receptors in deciphering ligand-binding surfaces Marimuthu ParthibanPiramanayagam ShanmughavelRamanathan Sowdhamini Original Paper 05 March 2010 Pages: 1651 - 1670