Detalhe da pesquisa
1.
Structure of the human respiratory complex II.
Proc Natl Acad Sci U S A
; 120(18): e2216713120, 2023 05 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-37098072
2.
3D based generative PROTAC linker design with reinforcement learning.
Brief Bioinform
; 24(5)2023 09 20.
Artigo
em Inglês
| MEDLINE | ID: mdl-37670499
3.
A specific JMJD6 inhibitor potently suppresses multiple types of cancers both in vitro and in vivo.
Proc Natl Acad Sci U S A
; 119(34): e2200753119, 2022 08 23.
Artigo
em Inglês
| MEDLINE | ID: mdl-35969736
4.
An extensive benchmark study on biomedical text generation and mining with ChatGPT.
Bioinformatics
; 39(9)2023 Sep 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-37682111
5.
Mass Flow and Metabolic Pathway of Nonaeration Greywater Treatment in an Oxygenic Microalgal-Bacterial Biofilm.
Environ Sci Technol
; 58(1): 534-544, 2024 Jan 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-38108291
6.
Development of 3-acetylindole derivatives that selectively target BRPF1 as new inhibitors of receptor activator of NF-κB ligand (RANKL)-Induced osteoclastogenesis.
Bioorg Med Chem
; 96: 117440, 2023 12 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-37951134
7.
De Novo Molecule Design Through the Molecular Generative Model Conditioned by 3D Information of Protein Binding Sites.
J Chem Inf Model
; 61(7): 3240-3254, 2021 07 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-34197105
8.
Kinase Inhibitor Scaffold Hopping with Deep Learning Approaches.
J Chem Inf Model
; 61(10): 4900-4912, 2021 10 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-34586824
9.
CHARMM36m: an improved force field for folded and intrinsically disordered proteins.
Nat Methods
; 14(1): 71-73, 2017 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-27819658
10.
Virtual Screening with a Structure-Based Pharmacophore Model to Identify Small-Molecule Inhibitors of CARM1.
J Chem Inf Model
; 59(1): 522-534, 2019 01 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-30607947
11.
QSAR modeling and in silico design of small-molecule inhibitors targeting the interaction between E3 ligase VHL and HIF-1α.
Mol Divers
; 21(3): 719-739, 2017 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-28689235
12.
Identification of Covalent Binding Sites Targeting Cysteines Based on Computational Approaches.
Mol Pharm
; 13(9): 3106-18, 2016 09 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-27483186
13.
Targeting epigenetic reader and eraser: Rational design, synthesis and in vitro evaluation of dimethylisoxazoles derivatives as BRD4/HDAC dual inhibitors.
Bioorg Med Chem Lett
; 26(12): 2931-2935, 2016 06 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-27142751
14.
Synthesis and Biological Evaluation of 1-(2-Aminophenyl)-3-arylurea Derivatives as Potential EphA2 and HDAC Dual Inhibitors.
Chem Pharm Bull (Tokyo)
; 64(8): 1136-41, 2016.
Artigo
em Inglês
| MEDLINE | ID: mdl-27477652
15.
A selectivity study of sodium-dependent glucose cotransporter 2/sodium-dependent glucose cotransporter 1 inhibitors by molecular modeling.
J Mol Recognit
; 28(8): 467-79, 2015 Aug.
Artigo
em Inglês
| MEDLINE | ID: mdl-25753971
16.
Fragment virtual screening based on Bayesian categorization for discovering novel VEGFR-2 scaffolds.
Mol Divers
; 19(4): 895-913, 2015 Nov.
Artigo
em Inglês
| MEDLINE | ID: mdl-26022686
17.
Studies on [5,6]-Fused Bicyclic Scaffolds Derivatives as Potent Dual B-RafV600E/KDR Inhibitors Using Docking and 3D-QSAR Approaches.
Int J Mol Sci
; 16(10): 24451-74, 2015 Oct 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-26501259
18.
An efficient multistep ligand-based virtual screening approach for GPR40 agonists.
Mol Divers
; 18(1): 183-93, 2014 Feb.
Artigo
em Inglês
| MEDLINE | ID: mdl-24307222
19.
Novel 1H-pyrazole-3-carboxamide derivatives: synthesis, anticancer evaluation and identification of their DNA-binding interaction.
Chem Pharm Bull (Tokyo)
; 62(3): 238-46, 2014.
Artigo
em Inglês
| MEDLINE | ID: mdl-24365978
20.
A CARM1 Inhibitor Potently Suppresses Breast Cancer Both In Vitro and In Vivo.
J Med Chem
; 67(10): 7921-7934, 2024 May 23.
Artigo
em Inglês
| MEDLINE | ID: mdl-38713486