http://vital.seals.ac.za:8080/vital/access/manager/Index ${session.getAttribute("locale")} 5 Characterisation of plasmodial transketolases and identification of potential inhibitors: an in silico study http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:72605 Wed 22 May 2024 03:42:08 SAST ]]> AMBER force field parameters for the Zn (II) ions of the tunneling-fold enzymes GTP cyclohydrolase I and 6-pyruvoyl tetrahydropterin synthase: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41009 Tue 09 Aug 2022 05:59:32 SAST ]]> Potential repurposing of four FDA approved compounds with antiplasmodial activity identified through proteome scale computational drug discovery and in vitro assay http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:42830 Tue 09 Aug 2022 05:58:00 SAST ]]> SANCDB: a South African natural compound database http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38730 Tue 07 May 2024 16:00:14 SAST ]]> Study of protein complexes via homology modeling, applied to cysteine proteases and their protein inhibitors: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38707 Tue 07 May 2024 10:56:19 SAST ]]> Comparative structural bioinformatics analysis of Bacillus amyloliquefaciens chemotaxis proteins within Bacillus subtilis group http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35521 Tue 07 May 2024 10:55:54 SAST ]]> Analysis of protein thermostability enhancing factors in industrially important thermus bacteria species http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35404 Tue 07 May 2024 10:55:10 SAST ]]> Sequence and domain conservation of the coelacanth Hsp40 and Hsp90 chaperones suggests conservation of function http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35936 Tue 07 May 2024 10:54:39 SAST ]]> How to establish a bioinformatics postgraduate degree programme—a case study from South Africa http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35641 Tue 07 May 2024 10:54:11 SAST ]]> Bioinformatics education—perspectives and challenges out of Africa http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35420 Tue 07 May 2024 10:53:47 SAST ]]> Bioinformatics and data analysis in microbiology: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38710 Tue 07 May 2024 10:53:23 SAST ]]> Plasmodium falciparum Hop: detailed analysis on complex formation with Hsp70 and Hsp90 http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35810 Tue 07 May 2024 10:52:11 SAST ]]> Plasmodium falciparum Hop: detailed analysis on complex formation with Hsp70 and Hsp90 http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41046 Tue 07 May 2024 10:51:54 SAST ]]> JMS: an open source workflow management system and web-based cluster front-end for high performance computing http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40993 Tue 07 May 2024 10:51:39 SAST ]]> JMS: a workflow management system and web-based cluster front-end for the Torque resource manager http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38705 Tue 07 May 2024 10:51:23 SAST ]]> Human, vector and parasite Hsp90 proteins: a comparative bioinformatics analysis http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38704 Tue 07 May 2024 10:50:59 SAST ]]> The development of computational biology in South Africa: successes achieved and lessons learnt http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38731 Tue 07 May 2024 10:50:34 SAST ]]> Subcellular localisation of Theiler's murine encephalomyelitis virus (TMEV) capsid subunit VP1 vis-á-vis host protein Hsp90: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38702 Tue 07 May 2024 10:50:14 SAST ]]> Structure based docking and molecular dynamic studies of plasmodial cysteine proteases against a South African natural compound and its analogs: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38703 Tue 07 May 2024 10:49:53 SAST ]]> Bioinformatic characterization of type-specific sequence and structural features in auxiliary activity family 9 proteins: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38732 Tue 07 May 2024 10:49:09 SAST ]]> Analysis of non-peptidic compounds as potential malarial inhibitors against plasmodial cysteine proteases via integrated virtual screening workflow http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35403 Tue 07 May 2024 10:48:26 SAST ]]> The role of structural bioinformatics in drug discovery via computational SNP analysis–a proposed protocol for analyzing variation at the protein level: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40996 Tue 07 May 2024 10:47:45 SAST ]]> The global distribution and diversity of protein vaccine candidate antigens in the highly virulent Streptococcus pnuemoniae serotype: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38729 Tue 07 May 2024 10:47:20 SAST ]]> The evaluation and validation of copper (II) force field parameters of the Auxiliary Activity family 9 enzymes: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38719 Tue 07 May 2024 10:46:56 SAST ]]> Structure-based analysis of single nucleotide variants in the renin-angiotensinogen complex: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38700 Tue 07 May 2024 10:46:33 SAST ]]> Role of structural bioinformatics in drug discovery by computational SNP analysis: analyzing variation at the protein level http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35832 Tue 07 May 2024 10:46:16 SAST ]]> PRIMO: an interactive homology modeling pipeline http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38726 Tue 07 May 2024 10:45:51 SAST ]]> Perturbation–Response Scanning reveals key residues for Allosteric Control in Hsp70: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38718 Tue 07 May 2024 10:45:25 SAST ]]> No evidence for association with APOL1 kidney disease risk alleles and Human African Trypanosomiasis in two Ugandan populations: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38725 Tue 07 May 2024 10:45:07 SAST ]]> MD-TASK: a software suite for analyzing molecular dynamics trajectories http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35735 Tue 07 May 2024 10:44:45 SAST ]]> Interacting motif networks located in hotspots associated with RNA release are conserved in Enterovirus capsids http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35704 Tue 07 May 2024 10:44:24 SAST ]]> Development of Bioinformatics Infrastructure for Genomics Research: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38722 Tue 07 May 2024 10:43:49 SAST ]]> Allosteric modulation of conformational dynamics in human Hsp90α: a computational study http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:29276 Tue 07 May 2024 10:43:13 SAST ]]> Unraveling the Motions behind Enterovirus 71 Uncoating: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38715 Tue 07 May 2024 10:42:17 SAST ]]> The generation and characterisation of neutralising antibodies against the Theiler’s murine encephalomyelitis virus (TMEV) GDVII capsid reveals the potential binding site of the host cell co-receptor, heparan sulfate: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38717 Tue 07 May 2024 10:41:43 SAST ]]> The determination of CHARMM force field parameters for the Mg2+ containing HIV-1 integrase: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38713 Tue 07 May 2024 10:40:58 SAST ]]> No evidence for association between APOL1 kidney disease risk alleles and Human African Trypanosomiasis in two Ugandan populations: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40997 Tue 07 May 2024 10:40:33 SAST ]]> Modulation of human Hsp90α conformational dynamics by allosteric ligand interaction at the c-terminal domain: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38736 Tue 07 May 2024 10:40:09 SAST ]]> MODE-TASK: Large-scale protein motion tools http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35746 Tue 07 May 2024 10:39:46 SAST ]]> HUMA: A platform for the analysis of genetic variation in humans http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35642 Tue 07 May 2024 10:39:25 SAST ]]> Homology modeling and docking of AahII-Nanobody complexes reveal the epitope binding site on AahII scorpion toxin http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35637 Tue 07 May 2024 10:38:57 SAST ]]> Hepatitis C and HIV Coinfection in Developing Countries: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38721 Tue 07 May 2024 10:38:36 SAST ]]> Establishment of “The South African Bioinformatics Student Council” and activity highlights: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38723 Tue 07 May 2024 10:38:11 SAST ]]> Comparing sequence and structure of falcipains and human homologs at prodomain and catalytic active site for malarial peptide-based inhibitor design: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38735 Tue 07 May 2024 10:37:49 SAST ]]> Aminoacyl tRNA synthetases as malarial drug targets: a comparative bioinformatics study http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38733 Tue 07 May 2024 10:37:09 SAST ]]> Allosteric Modulation of Human Hsp90α Conformational Dynamics: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40998 Tue 07 May 2024 10:36:50 SAST ]]> South African Abietane Diterpenoids and their analogs as potential antimalarials: novel insights from hybrid computational approaches http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40971 Tue 07 May 2024 10:36:11 SAST ]]> Novel potential antimalarials through drug repurposing and multitargeting: a Computational Approach http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40972 Tue 07 May 2024 10:35:50 SAST ]]> Mechanism of action of non-synonymous single nucleotide variations associated with α-carbonic anhydrase II deficiency: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40970 Tue 07 May 2024 10:35:26 SAST ]]> In silico study of Plasmodium 1-deoxy-d-xylulose 5-phosphate reductoisomerase (DXR) for identification of novel inhibitors from SANCDB: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40973 Tue 07 May 2024 10:34:56 SAST ]]> Identification of Novel Potential Inhibitors of Pteridine Reductase 1 in Trypanosoma brucei via Computational Structure-Based Approaches and in Vitro Inhibition Assays http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:35647 Tue 07 May 2024 10:34:28 SAST ]]> Establishing computational approaches towards identifying malarial allosteric modulators: a case study of plasmodium falciparum hsp70s http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41003 Tue 07 May 2024 10:33:45 SAST ]]> Discorhabdin N, a South African Natural Compound, for Hsp72 and Hsc70 Allosteric Modulation: combined study of molecular modeling and dynamic residue network analysis http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40999 Tue 07 May 2024 10:32:56 SAST ]]> Computational analysis of missense mutations from the human Macrophage Migration Inhibitory Factor (MIF) protein by Molecular Dynamics Simulations and Dynamic Residue Network Analysis: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41021 Tue 07 May 2024 10:32:26 SAST ]]> Comparing sequence and structure of falcipains and human homologs at prodomain and catalytic active site for malarial peptide based inhibitor design: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41000 Tue 07 May 2024 10:32:03 SAST ]]> Anti-HIV-1 integrase potency of methylgallate from Alchornea cordifolia using in vitro and in silico approaches: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41001 Tue 07 May 2024 10:31:36 SAST ]]> Allosteric site modulators: a case study for falcipains as malarial drug targets http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40974 Tue 07 May 2024 10:31:13 SAST ]]> Understanding the Pyrimethamine drug resistance mechanism via combined molecular dynamics and dynamic residue network analysis: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41005 Tue 07 May 2024 10:30:46 SAST ]]> The In Silico Prediction of hotspot residues that contribute to the structural stability of subunit interfaces of a Picornavirus Capsid: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38919 Tue 07 May 2024 10:30:12 SAST ]]> Structural Characterization of Carbonic Anhydrase VIII and Effects of Missense Single Nucleotide Variations to Protein Structure and Function: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38873 Tue 07 May 2024 10:29:09 SAST ]]> Probing the structural dynamics of the Plasmodium falciparum tunneling-fold enzyme 6-pyruvoyl tetrahydropterin synthase to reveal allosteric drug targeting sites: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41008 Tue 07 May 2024 10:28:47 SAST ]]> Integrated computational approaches and tools for allosteric drug discovery: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41004 Tue 07 May 2024 10:28:29 SAST ]]> Impact of emerging mutations on the dynamic properties the SARS-CoV-2 main protease: an in silico investigation http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:41006 Tue 07 May 2024 10:28:06 SAST ]]> Impact of early pandemic stage mutations on molecular dynamics of SARS-CoV-2 Mpro: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:40835 Tue 07 May 2024 10:24:10 SAST ]]> Identification of Selective Novel Hits against Plasmodium falciparum Prolyl tRNA Synthetase Active Site and a Predicted Allosteric Site Using in silico Approaches: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38817 Tue 07 May 2024 10:23:52 SAST ]]> Determining the unbinding events and conserved motions associated with the pyrazinamide release due to resistance mutations of Mycobacterium tuberculosis pyrazinamidase: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38781 Tue 07 May 2024 10:23:34 SAST ]]> The PINIT domain of PIAS3: structure-function analysis of its interaction with STAT3 http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38708 Thu 16 May 2024 05:13:59 SAST ]]> Improving fold resistance prediction of HIV-1 against protease and reverse transcriptase inhibitors using artificial neural networks: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38724 Thu 11 Aug 2022 06:27:34 SAST ]]> Characterizing early drug resistance-related events using geometric ensembles from HIV protease dynamics: http://vital.seals.ac.za:8080/vital/access/manager/Repository/vital:38712 Thu 11 Aug 2022 06:27:06 SAST ]]>