Roles of virtual screening and molecular dynamics simulations in discovering and understanding antimalarial drugs
Malaria continues to be a global health threat, with approximately 247 million cases
worldwide. Despite therapeutic interventions being available, patient compliance is a …
worldwide. Despite therapeutic interventions being available, patient compliance is a …
Theoretical studies of Thiazolyl-Pyrazoline derivatives as promising drugs against malaria by QSAR modelling combined with molecular docking and molecular …
We investigate thiazolyl-pyrazoline derivatives as promising drugs for the anti-malarial.
Protein kinase G is a primary target for treating malaria due to its essential role in …
Protein kinase G is a primary target for treating malaria due to its essential role in …
An Interpretable Machine Learning Strategy for Antimalarial Drug Discovery with LightGBM and SHAP
Malaria continues to pose a significant global health threat, and the emergence of drug-
resistant malaria exacerbates the challenge, underscoring the urgent need for new …
resistant malaria exacerbates the challenge, underscoring the urgent need for new …
Implementation of simulated annealing-support vector machine on QSAR study of fusidic acid derivatives as anti-malarial agent
F Rahman, KM Lhaksmana… - 2020 6th International …, 2020 - ieeexplore.ieee.org
Malaria is a disease caused by the Plasmodium falciparum parasite and leads to many
cases of deaths. Recently, the combination of several drugs has been used to treat this …
cases of deaths. Recently, the combination of several drugs has been used to treat this …
QSAR study on falcipain inhibitors as anti-malaria using genetic algorithm-support vector machine
MF Ambiar, A Aditsania… - 2022 5th International …, 2022 - ieeexplore.ieee.org
Malaria is a dangerous endemic disease that infects millions yearly. The Plasmodium
falciparum species are responsible for most malaria deaths. Currently, most available …
falciparum species are responsible for most malaria deaths. Currently, most available …
Implementation of Simulated Annealing-Support Vector Machine on QSAR Study of Indenopyrazole Derivative as Anti-Cancer Agent
MF Rizqi, RR Septiawan… - 2021 9th International …, 2021 - ieeexplore.ieee.org
Cancer is a disease that occurs due to the uncontrolled growth of abnormal cells causing
body tissue damage. This disease is considered as a deadly disease. In 2019, 1700 deaths …
body tissue damage. This disease is considered as a deadly disease. In 2019, 1700 deaths …
QSAR Study on Diacylgycerol Acyltransferase-1 (DGAT-1) Inhibitor as Anti-diabetic using PSO-SVM Methods
IKAPP Pramana, RR Septiawan… - Jurnal RESTI (Rekayasa …, 2022 - jurnal.iaii.or.id
Diabetes mellitus is a chronic disease that can occur in anyone. Up until now, there are no
specific drugs have been found which can completely cure diabetes. One of the possible …
specific drugs have been found which can completely cure diabetes. One of the possible …
Prediction of Human β-secretase 1 (BACE-1) Inhibitors for Alzheimer Therapeutic Agent by Using Fingerprint-based Neural Network Optimized by Bat Algorithm
AF Nugroho, RR Septiawan… - … on Computer Science …, 2023 - ieeexplore.ieee.org
Dementia is a fast-growing public health problem, with an estimated 47 million people
currently living with the condition. By 2030, this total is predicted to reach 75 million. By …
currently living with the condition. By 2030, this total is predicted to reach 75 million. By …
QSAR Study of Larvicidal Phytocompounds as Anti-Aedes Aegypti by using GA-SVM Method
K Triolascarya, RR Septiawan… - Jurnal RESTI (Rekayasa …, 2022 - jurnal.iaii.or.id
Aedes aegypti is one of the most dangerous mosquitoes that can cause several deadly
diseases, such as dengue fever, Chikungunya, Zika, and jaundice with high mortality rate …
diseases, such as dengue fever, Chikungunya, Zika, and jaundice with high mortality rate …
Computer-aided molecular design of 2-anilino 4-amino substituted quinazolines derivatives as malarial inhibitors
Quantitative structure–activity relationship studies conducted on forty-five (45) derivatives of
2-anilino 4-amino substituted quinazolines as malaria inhibitors to determine the structures …
2-anilino 4-amino substituted quinazolines as malaria inhibitors to determine the structures …