Lv1
20 积分 2025-10-08 加入
Phosphorylation Modification Force Field FB18CMAP Improving Conformation Sampling of Phosphoproteins
13天前
已完结
To Probe the Binding Interactions between Two FDA Approved Migraine Drugs (Ubrogepant and Rimegepant) and Calcitonin-Gene Related Peptide Receptor (CGRPR) Using Molecular Dynamics Simulations
22天前
已完结
Hydrogen-Bond-Assisted Catalysis: Hydroxylation of Paclitaxel by Human CYP2C8
23天前
已完结
Unveiling Cooperative Effects of Two Bidentate Pyridone-Pyrazole Ligands in the Regioselective C–H Activation: A Theoretical Study
1个月前
已完结
Extra Precision Glide: Docking and Scoring Incorporating a Model of Hydrophobic Enclosure for Protein−Ligand Complexes
1个月前
已完结
Extra Precision Glide: Docking and Scoring Incorporating a Model of Hydrophobic Enclosure for Protein−Ligand Complexes
1个月前
已完结
Glide: A New Approach for Rapid, Accurate Docking and Scoring. 1. Method and Assessment of Docking Accuracy
1个月前
已完结
Identification and Characterization of Noncovalent Interactions That Drive Binding and Specificity in DD-Peptidases and β-Lactamases
1个月前
已完结
Enzymatic Stetter Reaction: Computational Study of the Reaction Mechanism of MenD
2个月前
已完结
Mechanistic Studies on Iron-Catalyzed Dehydrogenation of Amines Involving Cyclopentadienone Iron Complexes─Evidence for Stepwise Hydride and Proton Transfer
2个月前
已完结
Long-range magnetic interaction of native defects in transition metal dichalcogenides
3个月前
已采纳
First-Principles Investigation of the OsI$$_{2}$$ Monolayer: A Novel Two-Dimensional Dihalide Material for Optoelectronic Applications
3个月前
已采纳
Parental RNA interference (pRNAi) in insects: mechanisms, applications, and challenges in pest management
3个月前
已采纳
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