Detalhe da pesquisa
1.
FEP Augmentation as a Means to Solve Data Paucity Problems for Machine Learning in Chemical Biology.
J Chem Inf Model
; 64(9): 3812-3825, 2024 May 13.
Artigo
em Inglês
| MEDLINE | ID: mdl-38651738
2.
Mechanistic Insight into NMDA Receptor Dysregulation by Rare Variants in the GluN2A and GluN2B Agonist Binding Domains.
Am J Hum Genet
; 99(6): 1261-1280, 2016 Dec 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-27839871
3.
One Among Millions: The Chemical Space of Nucleic Acid-Like Molecules.
J Chem Inf Model
; 59(10): 4266-4277, 2019 10 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-31498614
4.
Error Tolerance of Machine Learning Algorithms across Contemporary Biological Targets.
Molecules
; 24(11)2019 Jun 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-31167452
5.
The Bioactive Protein-Ligand Conformation of GluN2C-Selective Positive Allosteric Modulators Bound to the NMDA Receptor.
Mol Pharmacol
; 93(2): 141-156, 2018 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-29242355
6.
A structurally derived model of subunit-dependent NMDA receptor function.
J Physiol
; 596(17): 4057-4089, 2018 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-29917241
7.
A Machine Learning Approach for Predicting HIV Reverse Transcriptase Mutation Susceptibility of Biologically Active Compounds.
J Chem Inf Model
; 58(8): 1544-1552, 2018 08 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-29953819
8.
Functional Evaluation of a De Novo GRIN2A Mutation Identified in a Patient with Profound Global Developmental Delay and Refractory Epilepsy.
Mol Pharmacol
; 91(4): 317-330, 2017 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-28126851
9.
A novel inhibitor of Plasmodium falciparum spermidine synthase: a twist in the tail.
Malar J
; 14: 54, 2015 Feb 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-25651815
10.
Structural determinants and mechanism of action of a GluN2C-selective NMDA receptor positive allosteric modulator.
Mol Pharmacol
; 86(5): 548-60, 2014 Nov.
Artigo
em Inglês
| MEDLINE | ID: mdl-25205677
11.
Exploring inhibition of Pdx1, a component of the PLP synthase complex of the human malaria parasite Plasmodium falciparum.
Biochem J
; 449(1): 175-87, 2013 Jan 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-23039077
12.
Anthracene-polyamine conjugates inhibit in vitro proliferation of intraerythrocytic Plasmodium falciparum parasites.
Antimicrob Agents Chemother
; 57(6): 2874-7, 2013 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-23545535
13.
Discovery-2: an interactive resource for the rational selection and comparison of putative drug target proteins in malaria.
Malar J
; 12: 116, 2013 Mar 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-23537208
14.
Mapping the binding of GluN2B-selective N-methyl-D-aspartate receptor negative allosteric modulators.
Mol Pharmacol
; 82(2): 344-59, 2012 Aug.
Artigo
em Inglês
| MEDLINE | ID: mdl-22596351
15.
Identification and Characterization of Novel Small-Molecule SMOX Inhibitors.
Med Sci (Basel)
; 10(3)2022 08 30.
Artigo
em Inglês
| MEDLINE | ID: mdl-36135832
16.
Small molecules targeting the NADH-binding pocket of VDAC modulate mitochondrial metabolism in hepatocarcinoma cells.
Biomed Pharmacother
; 150: 112928, 2022 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-35447542
17.
Structural determinants of D-cycloserine efficacy at the NR1/NR2C NMDA receptors.
J Neurosci
; 30(7): 2741-54, 2010 Feb 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-20164358
18.
Mechanism for noncompetitive inhibition by novel GluN2C/D N-methyl-D-aspartate receptor subunit-selective modulators.
Mol Pharmacol
; 80(5): 782-95, 2011 Nov.
Artigo
em Inglês
| MEDLINE | ID: mdl-21807990
19.
Selective targeting of CD38 hydrolase and cyclase activity as an approach to immunostimulation.
RSC Adv
; 11(53): 33260-33270, 2021 Oct 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-35497564
20.
Distinct GluN1 and GluN2 Structural Determinants for Subunit-Selective Positive Allosteric Modulation of N-Methyl-d-aspartate Receptors.
ACS Chem Neurosci
; 12(1): 79-98, 2021 01 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-33326224