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1.
Multipolar Atom Types from Theory and Statistical Clustering (MATTS) Data Bank: Restructurization and Extension of UBDB.
J Chem Inf Model
; 62(16): 3752-3765, 2022 08 22.
Artículo
en Inglés
| MEDLINE | ID: mdl-35943747
2.
Activation of the Hg-C Bond of Methylmercury by [S2]-Donor Ligands.
Inorg Chem
; 56(20): 12102-12115, 2017 Oct 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-28952723
3.
Synthesis of novel 5-arylidenethiazolidinones with apoptotic properties via a three component reaction using piperidine as a bifunctional reagent.
Org Biomol Chem
; 14(34): 8053-63, 2016 Sep 14.
Artículo
en Inglés
| MEDLINE | ID: mdl-27396309
4.
TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules.
Acta Crystallogr C Struct Chem
; 2024 Jul 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-38934273
5.
Aspherical atom refinements on X-ray data of diverse structures including disordered and covalent organic framework systems: a time-accuracy trade-off.
J Appl Crystallogr
; 56(Pt 1): 116-127, 2023 Feb 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-36777135
6.
TAAM: a reliable and user friendly tool for hydrogen-atom location using routine X-ray diffraction data.
Acta Crystallogr B Struct Sci Cryst Eng Mater
; 76(Pt 3): 296-306, 2020 Jun 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-32831250
7.
Copper-Driven Deselenization: A Strategy for Selective Conversion of Copper Ion to Nanozyme and Its Implication for Copper-Related Disorders.
ACS Appl Mater Interfaces
; 11(5): 4766-4776, 2019 Feb 06.
Artículo
en Inglés
| MEDLINE | ID: mdl-30644707
8.
Reciprocal carbonyl-carbonyl interactions in small molecules and proteins.
Nat Commun
; 8(1): 78, 2017 07 19.
Artículo
en Inglés
| MEDLINE | ID: mdl-28724906
9.
Identification of Leishmania donovani Topoisomerase 1 inhibitors via intuitive scaffold hopping and bioisosteric modification of known Top 1 inhibitors.
Sci Rep
; 6: 26603, 2016 05 25.
Artículo
en Inglés
| MEDLINE | ID: mdl-27221589
10.
Corrigendum: Identification of Leishmania donovani Topoisomerase 1 inhibitors via intuitive scaffold hopping and bioisosteric modification of known Top 1 inhibitors.
Sci Rep
; 6: 28120, 2016 06 20.
Artículo
en Inglés
| MEDLINE | ID: mdl-27323004
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