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SAR and QSAR in Environmental Research Volume 28, 2017 - Issue 11: Special Issue: 9th International Symposium on Computational Methods in Toxicology and Pharmacology Integrating Internet Resources (CMTPI-2017) - Part 2. Guest Editors: A.K. Saxena and M. Saxena
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Special Issue: 9th International Symposium on Computational Methods in Toxicology and Pharmacology Integrating Internet Resources (CMTPI-2017) - Part 2. Guest Editors: A.K. Saxena and M. Saxena

Molecular property diagnostic suite (MPDS): Development of disease-specific open source web portals for drug discoveryFootnote$

S. NagamaniCentre for Molecular Modeling, CSIR-Indian Institute of Chemical Technology, Hyderabad, India
,
A. S. GaurCentre for Molecular Modeling, CSIR-Indian Institute of Chemical Technology, Hyderabad, India
,
K. TanneeruCentre for Molecular Modeling, CSIR-Indian Institute of Chemical Technology, Hyderabad, India
,
G. MuneeswaranCentre for Molecular Modeling, CSIR-Indian Institute of Chemical Technology, Hyderabad, India
,
S. S. MadugulaCentre for Molecular Modeling, CSIR-Indian Institute of Chemical Technology, Hyderabad, India
,
MPDS Consortium
,
D. DruzhilovskiyInstitute of Biomedical Chemistry, Moscow, RussiaORCID Iconhttp://orcid.org/0000-0001-9024-1331
ORCID Icon,
V. V. PoroikovInstitute of Biomedical Chemistry, Moscow, RussiaORCID Iconhttp://orcid.org/0000-0001-7937-2621
ORCID Icon &
G. N. SastryCentre for Molecular Modeling, CSIR-Indian Institute of Chemical Technology, Hyderabad, IndiaCorrespondence[email protected]
ORCID Iconhttp://orcid.org/0000-0003-3181-7673
ORCID Icon show all
Pages 913-926 | Received 03 Nov 2017, Accepted 06 Nov 2017, Published online: 05 Dec 2017

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Anamika Singh Gaur, Selvaraman Nagamani, Lipsa Priyadarsinee, Hridoy J. Mahanta, Ramakrishnan Parthasarathi & G. Narahari Sastry. (2023) Galaxy for open-source computational drug discovery solutions. Expert Opinion on Drug Discovery 18:6, pages 579-590.
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Articles from other publishers (7)

Lijo John, Selvaraman Nagamani, Hridoy Jyoti Mahanta, S. Vaikundamani, Nandan Kumar, Asheesh Kumar, Esther Jamir, Lipsa Priyadarsinee & G. Narahari Sastry. (2023) Molecular Property Diagnostic Suite Compound Library (MPDS-CL): a structure-based classification of the chemical space. Molecular Diversity.
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Bitopan Mazumdar, Pankaj Kumar Deva Sarma, Hridoy Jyoti Mahanta & G. Narahari Sastry. (2023) Machine learning based dynamic consensus model for predicting blood-brain barrier permeability. Computers in Biology and Medicine 160, pages 106984.
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Anamika Singh Gaur, Lijo John, Nandan Kumar, M. Ram Vivek, Selvaraman Nagamani, Hridoy Jyoti Mahanta & G. Narahari Sastry. (2022) Towards systematic exploration of chemical space: building the fragment library module in molecular property diagnostic suite. Molecular Diversity 27:3, pages 1459-1468.
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Sweta Mohanty, Md. Harun Al Rashid, Chandana Mohanty & Swati Swayamsiddha. (2021) Modern computational intelligence based drug repurposing for diabetes epidemic. Diabetes & Metabolic Syndrome: Clinical Research & Reviews 15:4, pages 102180.
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Selvaraman Nagamani, Rosaleen Sahoo, Gurusamy Muneeswaran & G. Narahari Sastry. 2019. In Silico Drug Design. In Silico Drug Design 191 227 .
Chinmayee Choudhury & G. Narahari Sastry. 2019. Structural Bioinformatics: Applications in Preclinical Drug Discovery Process. Structural Bioinformatics: Applications in Preclinical Drug Discovery Process 25 53 .
Anamika Singh Gaur, Selvaraman Nagamani, Karunakar Tanneeru, Dmitry Druzhilovskiy, Anastassia Rudik, Vladimir Poroikov & G. Narahari Sastry. (2018) Molecular property diagnostic suite for diabetes mellitus (MPDSDM): An integrated web portal for drug discovery and drug repurposing. Journal of Biomedical Informatics 85, pages 114-125.
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