Detalhe da pesquisa
1.
Roughness of Molecular Property Landscapes and Its Impact on Modellability.
J Chem Inf Model
; 62(19): 4660-4671, 2022 10 10.
Artigo
em Inglês
| MEDLINE | ID: mdl-36112568
2.
Self-Focusing Virtual Screening with Active Design Space Pruning.
J Chem Inf Model
; 62(16): 3854-3862, 2022 08 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-35938299
3.
K-mer clustering algorithm using a MapReduce framework: application to the parallelization of the Inchworm module of Trinity.
BMC Bioinformatics
; 18(1): 467, 2017 Nov 03.
Artigo
em Inglês
| MEDLINE | ID: mdl-29100493
4.
Topological "Shape" in Micellar Dynamics.
ACS Omega
; 9(14): 16084-16088, 2024 Apr 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-38617615
5.
A computational model for overcoming drug resistance using selective dual-inhibitors for aurora kinase A and its T217D variant.
Mol Pharm
; 10(12): 4572-89, 2013 Dec 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-24094068
6.
Efficient Algorithm for the Topological Characterization of Worm-like and Branched Micelle Structures from Simulations.
J Chem Theory Comput
; 16(7): 4588-4598, 2020 Jul 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-32543855
7.
Toward a Standard Protocol for Micelle Simulation.
J Phys Chem B
; 120(26): 6337-51, 2016 07 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-27096611