Rafael Perurena García

Bachelor in Biochemistry and Molecular Biology with a focus on Bioinformatics.

[Rafael Perurena García @GarciaPerurena]

Hi @LatinXChem, this is my work 'DRUG REPOSITIONING FOR SARS-COV-2: SEARCH FOR 3CL PROTEASE
INHIBITORS USING PHARMACOPHORE-BASED VIRTUAL SCREENING, MOLECULAR
DOCKING AND MOLECULAR DYNAMICS',
#LatinXChem22 #LXChemComp #Comp068 #docking #moleculardynamics #pharmacophore #SARSCoV2

[Rafael Perurena García @GarciaPerurena]

@kshvbgde How much could cost a good over-ear headphones?

[Dianny @Dianny49275837]

Hi @LatinXChem, presenting my work “Development of ternary complexes with a Sticholysin conjugate, a polycationic peptide, and a DNA plasmid to promote gene delivery” at #LatinXChem24 #LatinXChemBio #Bio16 #GeneDelivery

[Rafael Perurena García @GarciaPerurena]

@joshuadun But why tyler eat it all in the way? He cannot stand down for a few more minutes. Jajajaj

[VTX @VTX_mol]

Freefly navigation inside Mycoplasma whole cell model from @CG_Martini captured with @NVIDIAGeForce experience on a laptop with RTX2080m
@MatthieuMontes @MaximeMARIA_ @sguionni @M2d2Team @InstitutXLIM @LeCnam @gemellyn @jppiquem @ERC_Research

[Rafael Perurena García @GarciaPerurena]

@xsgames_ Cry with GPT... XD

[Rafael Perurena García @GarciaPerurena]

@BatsouElef Python

[Rafael Perurena García @GarciaPerurena]

@anunesalves @LatinXChem We plan to continue this work by refining these molecules for better interaction with the protein, so we would start by substituting this sulfoxide group with some other group that shows better surface complementarity. Thanks for asking. (3/3)

[Rafael Perurena García @GarciaPerurena]

Hi @LatinXChem, this is my work 'DRUG REPOSITIONING FOR SARS-COV-2: SEARCH FOR 3CL PROTEASE
INHIBITORS USING PHARMACOPHORE-BASED VIRTUAL SCREENING, MOLECULAR
DOCKING AND MOLECULAR DYNAMICS',
#LatinXChem22 #LXChemComp #Comp068 #docking #moleculardynamics #pharmacophore #SARSCoV2

[Rafael Perurena García @GarciaPerurena]

@anunesalves @LatinXChem this group is uncoupled from the protein cavity, and exposed to the solvent accordingly, but the rest of the molecule remains bound in the cavity, so we see the jump between their COMs distances. (2/3)

[Rafael Perurena García @GarciaPerurena]

@anunesalves @LatinXChem Yes, we also analyzed the RMSD of the ligands in the complex to study their stability, but to demonstrate that the ligands remain within the active site we decided to show the distances between their COMs. Due to the high polarity of the sulfoxide group of the GDC, (1/3)

[Rafael Perurena García @GarciaPerurena]

@quimeds @LatinXChem And we plan to improve the accuracy of the affinity energy of the molecules listed in Table 2, through methods such as LIE or MM/PBSA using molecular dynamics.

[Rafael Perurena García @GarciaPerurena]

@quimeds @LatinXChem Hi! Yes, the dG values in the poster were obtained by the molecular docking protocol supported by the pharmacophore. All of these values are shown in graph 1, and in the table 2 are emphasized the values of the molecules with best liggand efficiency. Thanks for asking.

[Rafael Perurena García @GarciaPerurena]

@zenndayacoIeman I need the link the download this chapter

[Rafael Perurena García @GarciaPerurena]

@goal @casemiro, @LuisSuarez9

[Rafael Perurena García @GarciaPerurena]

@tylerrjoseph Heeei men i love this song, you gays are great, keep going

[Rafael Perurena García @GarciaPerurena]

@realDonaldTrump Stop the crying

[Rafael Perurena García @GarciaPerurena]

@dragonage Yeeea when he be lunch?

[Rafael Perurena García @GarciaPerurena]

@CNNEE Asi mismo...