Structure-based discovery of small molecule APC-Asef interaction inhibitors: In silico approaches and molecular dynamics simulations

بواسطة Jadav, Surender Singh, Macalino, Stephani Joy Y., Alluri, Ramesh
منشور في 2020

Expediting the design, discovery and development of anticancer drugs using computational approaches

بواسطة Basith, Shaherin, Cui, Minghua, Macalino, Stephani Joy Y., Choi, Sun
منشور في 2017

Role of computer-aided drug design in modern drug discovery

بواسطة Macalino, Stephani Joy Y., Gosu, Vijayakumar, Hong, Sunhye, Choi, Sun
منشور في 2015

In silico strategies in tuberculosis drug discovery

بواسطة Macalino, Stephani Joy Y., Billones, Junie B., Organo, Voltaire G., Carrillo, Maria Constancia O.
منشور في 2020

Computer-aided screening for potential inhibitory compounds against a Klebsiella pneumoniae local isolate containing SHV-1 and CTX-M antibiotic resistance genes

بواسطة Castro, Anna, Sy, Jamie Bernadette, Macalino, Stephani Joy Y., Morales, Nadia, Abid, Princess Alyssa, Billones, Junie, Carrillo, Maria Constancia
منشور في 2021

Roles of virtual screening and molecular dynamics simulations in discovering and understanding antimalarial drugs

بواسطة Duay, Searle Aichelle S., Yap, Rianne Casey Y., Gaitano, Arturo L., II, Santos, June Alexis A., Macalino, Stephani Joy Y.
منشور في 2023

Virtual screening against mycobacterium tuberculosis lipoate protein ligase B (MtbLipB) and in silico ADMET evaluation of top hits

بواسطة Billones, Junie B., Carrillo, Maria Constancia O., Organo, Voltaire G., Macalino, Stephani Joy Y., Emnacen, Inno A., Sy, Jamie Bernadette A.
منشور في 2013

Virtual screening against M. tuberculosis 7,8-diaminopelargonic acid synthase (MtbBioA) and in silico toxicity evaluation of top hits

بواسطة Billones, Junie B., Carrillo, Maria Constancia O., Organo, Voltaire G., Macalino, Stephani Joy Y., Emnacen, Inno A., Sy, Jamie Bernadette A.
منشور في 2014

Toward antituberculosis drugs: In silico screening of synthetic compounds against Mycobacterium tuberculosis L,D-transpeptidase 2

بواسطة Billones, Junie B., Carrillo, Maria Constancia O., Organo, Voltaire G., Macalino, Stephani Joy Y., Sy, Jamie Bernadette A., Emnacen, Inno A., Clavio, Nina Abigail B., Concepcion, Gisela P.
منشور في 2016

In silico discovery and in vitro activity of inhibitors against mycobacterium tuberculosis 7,8-diaminopelargonic acid synthase (Mtb BioA)

بواسطة Billones, Junie B., Carrillo, Maria Constancia O., Organo, Voltaire G., Sy, Jamie Bernadette A., Clavio, Nina Abigail B., Macalino, Stephani Joy Y., Emnacen, Inno A., Lee, Alexandra P., Ko, Paul Kenny L., Concepcion, Gisela P.
منشور في 2017

Structural and biochemical characterization of the curcumin-reducing activity of CurA from Vibrio vulnificus

بواسطة Park, Soo-Bong, Bae, Da-Woon, Clavio, Nina Abigail B., Zhao, Lei, Jeong, Chang-Sook, Choi, Bo Mee, Macalino, Stephani Joy Y., Cha, Hee-Jeong, Park, Jin-Byung, Lee, Jun Hyuck, Nam, Sang-Jip, Choi, Sun, Kim, Min-Kyu, Cha, Sun-Shin
منشور في 2018