nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Adaptive umbrella sampling of the potential energy: modified updating procedure of the umbrella potential and application to peptide folding
|
Bartels, Christian |
|
1999 |
101 |
1-3 |
p. 62-66 |
artikel |
2 |
Analyzing patterns between regular secondary structures using short structural building blocks defined by a hidden Markov model
|
Camproux, A. C. |
|
1999 |
101 |
1-3 |
p. 33-40 |
artikel |
3 |
A new “hydrophobic template” method detects segments forming transmembrane α-helical bundles in ion channels
|
Efremov, Roman G. |
|
1999 |
101 |
1-3 |
p. 73-76 |
artikel |
4 |
A statistical analytical approach to predict the secondary structure of proteins from amino acid sequence information
|
Tiwari, Shrish |
|
1999 |
101 |
1-3 |
p. 41-45 |
artikel |
5 |
C–H...O and C–H...N interactions in RNA structures
|
Brandl, Maria |
|
1999 |
101 |
1-3 |
p. 103-113 |
artikel |
6 |
Computational chemistry and the living world: from sequence to function
|
, |
|
1999 |
101 |
1-3 |
p. 1 |
artikel |
7 |
Dimer models for ErbB-2/neu transmembrane domains from molecular dynamics simulations
|
Sajot, Nicolas |
|
1999 |
101 |
1-3 |
p. 67-72 |
artikel |
8 |
Dynamics of the transmembrane domain of the ErbB-2 receptor
|
Duneau, Jean-Pierre |
|
1999 |
101 |
1-3 |
p. 87-91 |
artikel |
9 |
Enhanced protein crystallization around the metastable critical point
|
ten Wolde, Pieter Rein |
|
1999 |
101 |
1-3 |
p. 205-208 |
artikel |
10 |
Examining ligand-protein interactions with binding-energy landscapes
|
Rejto, Paul A. |
|
1999 |
101 |
1-3 |
p. 138-142 |
artikel |
11 |
How possible is the detection of correlated mutations?
|
Tufféry, P. |
|
1999 |
101 |
1-3 |
p. 9-15 |
artikel |
12 |
Identifying key electrostatic interactions in Rhizomucor miehei lipase: the influence of solvent dielectric
|
Jääskeläinen, Sanna |
|
1999 |
101 |
1-3 |
p. 175-179 |
artikel |
13 |
Information about the biologically relevant properties of Clostridium pasteurianum rubredoxin obtained from modeling and dynamics simulations of molecular variants
|
Moulis, J.-M. |
|
1999 |
101 |
1-3 |
p. 223-227 |
artikel |
14 |
Ion channels of biological membranes: prediction of single channel conductance
|
Ranatunga, Kishani M. |
|
1999 |
101 |
1-3 |
p. 97-102 |
artikel |
15 |
MCSS-based predictions of RNA binding sites
|
Leclerc, Fabrice |
|
1999 |
101 |
1-3 |
p. 131-137 |
artikel |
16 |
Modelling the active site of glyceraldehyde-3 phosphate dehydrogenase with the LSCF formalism
|
Cartier, Alain |
|
1999 |
101 |
1-3 |
p. 241-245 |
artikel |
17 |
Molecular dynamics simulations of the isolated domain 1 of annexin I
|
Huynh, Tru |
|
1999 |
101 |
1-3 |
p. 82-86 |
artikel |
18 |
Molecular modeling of the hypoxia-inducible factor-1 (HIF-1)
|
Michel, G. |
|
1999 |
101 |
1-3 |
p. 51-56 |
artikel |
19 |
Molecular modeling study of an abasic DNA undecamer duplex: d(GCGTGOGTGCG) · d(CGCACTCACGC)
|
Ayadi, L. |
|
1999 |
101 |
1-3 |
p. 121-125 |
artikel |
20 |
Molecular modelling of amphipathic basic model peptides: Interactions in aqueous solutions and in the presence of lipids
|
Sy, Denise |
|
1999 |
101 |
1-3 |
p. 92-96 |
artikel |
21 |
Neural networks to study invariant features of protein folding
|
Compiani, M. |
|
1999 |
101 |
1-3 |
p. 21-26 |
artikel |
22 |
Peptides in membranes: assessment of environmental effects via simulations using an implicit solvation model
|
Efremov, Roman G. |
|
1999 |
101 |
1-3 |
p. 170-174 |
artikel |
23 |
Poisson-Boltzmann calculations versus molecular dynamics simulations for calculating the electrostatic potential of a solvated peptide
|
Löffler, Gerald |
|
1999 |
101 |
1-3 |
p. 163-169 |
artikel |
24 |
Prediction of protein structure using a knowledge-based off-lattice united-residue force field and global optimization methods
|
Liwo, Adam |
|
1999 |
101 |
1-3 |
p. 16-20 |
artikel |
25 |
Prediction of solvent accessibility of amino acid residues: critical aspects
|
Mucchielli-Giorgi, M. H. |
|
1999 |
101 |
1-3 |
p. 186-193 |
artikel |
26 |
Prediction of stability changes upon single-site mutations using database-derived potentials
|
Gilis, Dimitri |
|
1999 |
101 |
1-3 |
p. 46-50 |
artikel |
27 |
SeqFold – fully automated fold recognition and modeling software – evaluation and application
|
Olszewski, Krzysztof A. |
|
1999 |
101 |
1-3 |
p. 57-61 |
artikel |
28 |
Sequence classification of water channels and related proteins in view of functional predictions
|
Tallur, B. |
|
1999 |
101 |
1-3 |
p. 77-81 |
artikel |
29 |
Sequence dependence of DNA radioprotection by the thiols WR-1065 and WR-151326
|
Sy, D. |
|
1999 |
101 |
1-3 |
p. 114-120 |
artikel |
30 |
Solution conformations of structured peptides: continuum electrostatics versus distance-dependent dielectric functions
|
Schaefer, Michael |
|
1999 |
101 |
1-3 |
p. 194-204 |
artikel |
31 |
Stabilization centers in various proteins
|
Dosztányi, Zsuzsanna |
|
1999 |
101 |
1-3 |
p. 27-32 |
artikel |
32 |
Structure effects on isomerization pathways and vibrational spectra of epoxysaccharides: a numerical study
|
Kirillova, Svetlana G. |
|
1999 |
101 |
1-3 |
p. 215-222 |
artikel |
33 |
Study of flexible joints and permanent bends in DNA fragments by brownian dynamics simulations
|
Chirico, Giuseppe |
|
1999 |
101 |
1-3 |
p. 126-130 |
artikel |
34 |
The effect of the protein environment on the structure and charge distribution of the retinal Schiff base in bacteriorhodopsin
|
Tajkhorshid, Emadeddin |
|
1999 |
101 |
1-3 |
p. 180-185 |
artikel |
35 |
Theoretical investigation of histidine-tryptophan preferential interactions
|
Alagona, Giuliano |
|
1999 |
101 |
1-3 |
p. 143-150 |
artikel |
36 |
Theoretical pKa calculations of proteins; the tyrosine and lysine residues of b-elicitin
|
Vogel, Hans J. |
|
1999 |
101 |
1-3 |
p. 159-162 |
artikel |
37 |
“Topohydrophobic positions” as key markers of globular protein folds
|
Poupon, Anne |
|
1999 |
101 |
1-3 |
p. 2-8 |
artikel |
38 |
Towards a theory of molecular recognition
|
Le Guennec, Patrick |
|
1999 |
101 |
1-3 |
p. 151-158 |
artikel |
39 |
Transition state structure invariance to model system size and calculation levels: a QM/MM study of the carboxylation step catalyzed by Rubisco
|
Moliner, V. |
|
1999 |
101 |
1-3 |
p. 228-233 |
artikel |
40 |
Transition-state structures for describing the enzyme-catalyzed mechanisms of rubisco
|
Andrés, J. |
|
1999 |
101 |
1-3 |
p. 234-240 |
artikel |
41 |
Why betaine crystallizes in high local Cs symmetry. An ab initio MO and DFT study of anhydrous betaine and betaine monohydrate
|
Nyrönen, Tommi H. |
|
1999 |
101 |
1-3 |
p. 209-214 |
artikel |