g_mmpbsaA GROMACS Tool for High-Throughput MM-PBSA Calculations von Kumari, Rashmi, Kumar, Rajendra, Lynn, Andrew

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ABC transportome inventory of human pathogenic yeast Candida glabrata: Phylogenetic and expression analysis von Kumari, Sonam, Kumar, Mohit, Khandelwal, Nitesh Kumar, Kumari, Priya, Varma, Mahendra, Vishwakarma, Poonam, Shahi, Garima, Sharma, Suman, Lynn, Andrew M, Prasad, Rajendra, Gaur, Naseem A

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Age differences and brain maturation provide insight into heterogeneous results in autism spectrum disorder von O'Hearn, Kirsten, Lynn, Andrew

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Mapping the FtsQBL divisome components in bacterial NTD pathogens as potential drug targets von Kaur, Harbinder, Lynn, Andrew M

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Design, synthesis, in-silico and biological evaluation of novel donepezil derivatives as multi-target-directed ligands for the treatment of Alzheimer's disease von Mishra, Chandra Bhushan, Kumari, Shikha, Manral, Apra, Prakash, Amresh, Saini, Vikas, Lynn, Andrew M., Tiwari, Manisha

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Elucidation of the structural stability and dynamics of heterogeneous intermediate ensembles in unfolding pathway of the N-terminal domain of TDP-43 von Prakash, Amresh, Kumar, Vijay, Meena, Naveen Kumar, Lynn, Andrew M

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Genome-wide analysis of PTR transporters in Candida species and their functional characterization in Candida auris von Khatoon, Rosy, Sharma, Suman, Prasad, Rajendra, Lynn, Andrew M., Prakash, Amresh, Banerjee, Atanu

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Functional connectivity differences in autism during face and car recognition: underconnectivity and atypical age‐related changes von Lynn, Andrew C., Padmanabhan, Aarthi, Simmonds, Daniel, Foran, William, Hallquist, Michael N., Luna, Beatriz, O'Hearn, Kirsten

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Identifying the natural polyphenol catechin as a multi-targeted agent against SARS-CoV-2 for the plausible therapy of COVID-19: an integrated computational approach von Mishra, Chandra Bhushan, Pandey, Preeti, Sharma, Ravi Datta, Malik, Md Zubbair, Mongre, Raj Kumar, Lynn, Andrew M, Prasad, Rajendra, Jeon, Raok, Prakash, Amresh

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Delineating the effect of mutations on the conformational dynamics of N-terminal domain of TDP-43 von Kumar, Vijay, Pandey, Preeti, Idrees, Danish, Prakash, Amresh, Lynn, Andrew.M.

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Cytochrome P450 2C9 polymorphism: Effect of amino acid substitutions on protein flexibility in the presence of tamoxifen von Manish, Manish, Lynn, Andrew M, Mishra, Smriti

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Implementation of homology based and non-homology based computational methods for the identification and annotation of orphan enzymes: using Mycobacterium tuberculosis H37Rv as a c... von Sinha, Swati, Lynn, Andrew M., Desai, Dhwani K.

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WHY "DOING WELL BY DOING GOOD" WENT WRONG: GETTING BEYOND "GOOD ETHICS PAYS" CLAIMS IN MANAGERIAL THINKING von Lynn, Andrew

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ABC-finder: A containerized web server for the identification and topology prediction of ABC proteins von Vishwakarma, Poonam, Meena, Naveen Kumar, Prasad, Rajendra, Lynn, Andrew M., Banerjee, Atanu

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Alterations in local stability and dynamics of A4V SOD1 in the presence of trifluoroethanol von Kumar, Vijay, Prakash, Amresh, Lynn, Andrew M.

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Bioinformatic Identification of ABC Transporters in Candida auris von Banerjee, Atanu, Vishwakarma, Poonam, Meena, Naveen Kumar, Lynn, Andrew M., Prasad, Rajendra

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GCAC: galaxy workflow system for predictive model building for virtual screening von Bharti, Deepak R, Hemrom, Anmol J, Lynn, Andrew M

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Intersection of network medicine and machine learning towards investigating the key biomarkers and pathways underlying amyotrophic lateral sclerosis: a systematic review von Das, Trishala, Kaur, Harbinder, Gour, Pratibha, Prasad, Kartikay, Lynn, Andrew M, Prakash, Amresh, Kumar, Vijay

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Virtual screening and free energy estimation for identifying Mycobacterium tuberculosis flavoenzyme DprE1 inhibitors von Niranjan Kumar, Srivastava, Rakesh, Prakash, Amresh, Lynn, Andrew M.

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Representational similarity analysis reveals atypical age-related changes in brain regions supporting face and car recognition in autism von O’Hearn, Kirsten, Larsen, Bart, Fedor, Jennifer, Luna, Beatriz, Lynn, Andrew

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