From The Mind Come Drugs of the Future
20
Pharmaceutical
Computational Probing of Watson–Crick/Hoogsteen Breathing in a DNA Duplex Containing N1-Methylated Adenine
관리자
2024-01-26
168
19
Insilico direct folding of thrombin-binding aptamer G-quadruplex at all-atom level
149
18
Predicting RNA structures via a simple van der Waals correction to an all-atom force field
150
17
A fully atomistic computer simulation study of cold denaturation of a β-hairpin
177
16
Polyaromatic hydrocarbon thin film layers on glass, dust, and polyurethane foam surfaces
162
15
Recent advances in thermomagnetic devices for spin-caloritronic phenomena
157
14
Equilibrium structures of water molecules confined within a multiply connected carbon nanotube: a molecular dynamics stu..
184
13
Highly L and D enantioselective variants of horseradish peroxidase discovered by an ultrahigh-throughput selection me..
2022-12-08
431
12
How a Single-Point Mutation in Horseradish Peroxidase Markedly Enhances Enantioselectivity
395
11
Sampling Long Time Scale Protein Motions: OSRW Simulation of Active Site Loop Conformational Free Energies in Formyl-..
461
10
Elucidation of Allosteric Inhibition Mechanism of 2‑Cys Human Peroxiredoxin by Molecular Modeling
415
9
Peptidines: glycine-amidine-based oligomers for solution- and solid-phase synthesis
438
8
Re-engineering the Immune Response to Metastatic Cancer: Antibody-Recruiting Small Molecules Targeting the Urokinase ..
428
7
Investigation of the effect of erythrosine B on amyloid beta peptide using molecular modeling
436
6
Computational approaches to predict binding interactions between mammalian tyrosinases and (S)-(+)-decursin and its a..
446