On the public citation graph
Enhancing Specificity and Sensitivity of Pharmacophore-Based Virtual Screening by Incorporating Chemical and Shape Features−A Case Study of HIV Protease Inhibitors
0 signed · 56 inferred · view as graph
Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.
Is this your work? Sign in with ORCID and put your name on the
claims that are yours.
Reference health. See whether every reference in this work resolves to a
known work and none has been retracted — and get a dated CiteStamped
badge you can embed.
What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/(sici)1521-3773(19991004)38:19<2894::aid-anie2894>3.0.co;2-fopenalex-snapshot
“Scaffold-Hopping” by Topological Pharmacophore Search: A Contribution to Virtual Screening
inferredcites →https://doi.org/10.1002/(sici)1521-3773(19991004)38:19<2896::aid-anie2896>3.0.co;2-3openalex-snapshot
Cascade Reactions in Quantitative Solid-State Syntheses
inferredcites →https://doi.org/10.1002/med.2610130305openalex-snapshot
Peptidomimetics derived from natural products
inferredcites →https://doi.org/10.1006/jmbi.2000.4018openalex-snapshot
How does a symmetric dimer recognize an asymmetric substrate? a substrate complex of HIV-1 protease
inferredcites →https://doi.org/10.1016/j.ddtec.2004.08.004openalex-snapshot
Scoring functions for protein–ligand interactions: a critical perspective
inferredcites →https://doi.org/10.1016/s0166-3542(98)00011-4openalex-snapshot
Recent developments in HIV protease inhibitor therapy
inferredcites →https://doi.org/10.1016/s0167-4838(99)00267-8openalex-snapshot
Structural and biochemical studies of retroviral proteases
inferredcites →https://doi.org/10.1016/s1093-3263(02)00204-8openalex-snapshot
Assessing the performance of OMEGA with respect to retrieving bioactive conformations
inferredcites →https://doi.org/10.1016/s1359-6446(97)01163-xopenalex-snapshot
Virtual screening—an overview
inferredcites →https://doi.org/10.1021/cr960370zopenalex-snapshot
Molecular Recognition of Protein−Ligand Complexes: Applications to Drug Design
inferredcites →https://doi.org/10.1021/ja0469378openalex-snapshot
Incorporating Protein Flexibility in Structure-Based Drug Discovery: Using HIV-1 Protease as a Test Case
inferredcites →https://doi.org/10.1021/jm0003992openalex-snapshot
Detailed Analysis of Scoring Functions for Virtual Screening
inferredcites →https://doi.org/10.1021/jm00381a002openalex-snapshot
Structure-activity relationships of C-terminal tri- and tetrapeptide fragments that inhibit gastrin activity
inferredcites →https://doi.org/10.1021/jm030267jopenalex-snapshot
Characteristic Physical Properties and Structural Fragments of Marketed Oral Drugs
inferredcites →https://doi.org/10.1021/jm030563wopenalex-snapshot
Conformational Analysis of Drug-Like Molecules Bound to Proteins: An Extensive Study of Ligand Reorganization upon Binding
inferredcites →https://doi.org/10.1021/jm049798dopenalex-snapshot
Comparison of Automated Docking Programs as Virtual Screening Tools
inferredcites →https://doi.org/10.1021/jm9708691openalex-snapshot
Pharmacophores Incorporating Numerous Excluded Volumes Defined by X-ray Crystallographic Structure in Three-Dimensional Database Searching: Application to the Thyroid Hormone Receptor
inferredcites →https://doi.org/10.1038/nrd941openalex-snapshot
Integration of virtual and high-throughput screening
inferredcites →https://doi.org/10.1038/nsb0197-8openalex-snapshot
Database of three-dimensional structures of HIV proteinases
inferredcites →https://doi.org/10.2174/1568026043388312openalex-snapshot
Non-Peptidic HIV Protease Inhibitors
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.1002/chin.200630235openalex-snapshot
Enhancing Specificity and Sensitivity of Pharmacophore‐Based Virtual Screening by Incorporating Chemical and Shape Features — A Case Study of HIV Protease Inhibitors.
inferred← citeshttps://doi.org/10.1002/jcc.20854openalex-snapshot
A self‐organizing algorithm for molecular alignment and pharmacophore development
inferred← citeshttps://doi.org/10.1002/qsar.200610097openalex-snapshot
Similarity Metrics and Descriptor Spaces – Which Combinations to Choose?
inferred← citeshttps://doi.org/10.1007/978-981-10-3573-9_11openalex-snapshot
High-Throughput and In Silico Screening in Drug Discovery
inferred← citeshttps://doi.org/10.1007/s10822-025-00751-9openalex-snapshot
Integrating traditional and modern approaches for comprehensive pharmacophore map validation in drug discovery
inferred← citeshttps://doi.org/10.1007/s11030-013-9493-3openalex-snapshot
An efficient multistep ligand-based virtual screening approach for GPR40 agonists
inferred← citeshttps://doi.org/10.1007/s40203-025-00414-5openalex-snapshot
Identification of dual inhibitors of ROCK1 and TGFBR1 for overcoming metastasis: an integrated pharmacophore and docking driven CADD strategy
inferred← citeshttps://doi.org/10.1016/b978-0-08-100098-4.00002-8openalex-snapshot
Structure-Based Ligand Design I
inferred← citeshttps://doi.org/10.1016/b978-0-323-90608-1.00002-2openalex-snapshot
Pharmacophore modeling in drug design
inferred← citeshttps://doi.org/10.1016/b978-0-323-91172-6.00023-6openalex-snapshot
Pharmacophore mapping and modeling approaches for drug development
inferred← citeshttps://doi.org/10.1016/j.cbi.2006.12.006openalex-snapshot
Computer-aided drug discovery and development (CADDD): In silico-chemico-biological approach
inferred← citeshttps://doi.org/10.1016/j.ejmech.2007.08.017openalex-snapshot
In silico screening of HIV-1 non-nucleoside reverse transcriptase and protease inhibitors
inferred← citeshttps://doi.org/10.1016/j.imu.2023.101162openalex-snapshot
Targeting Leishmania donovani sterol methyltransferase for leads using pharmacophore modeling and computational molecular mechanics studies
inferred← citeshttps://doi.org/10.1016/j.jmgm.2014.06.007openalex-snapshot
Development of a receptor model for efficient in silico screening of HIV-1 integrase inhibitors
inferred← citeshttps://doi.org/10.1016/j.jmgm.2014.11.015openalex-snapshot
Exploration of the structural requirements of HIV-protease inhibitors using pharmacophore, virtual screening and molecular docking approaches for lead identification
inferred← citeshttps://doi.org/10.1016/j.nexres.2026.102362openalex-snapshot
A comprehensive review of chemoinformatics: From molecular representation to data-driven design
inferred← citeshttps://doi.org/10.1021/acs.jcim.5b00056openalex-snapshot
Using Hierarchical Virtual Screening To Combat Drug Resistance of the HIV-1 Protease
inferred← citeshttps://doi.org/10.1021/acsomega.9b00843openalex-snapshot
Exploring Novel N -Myristoyltransferase Inhibitors: A Molecular Dynamics Simulation Approach
inferred← citeshttps://doi.org/10.1021/ci700089wopenalex-snapshot
Automated Pharmacophore Query Optimization with Genetic AlgorithmsA Case Study Using the MC4R System
inferred← citeshttps://doi.org/10.1021/ci900356mopenalex-snapshot
Comparison of Three Preprocessing Filters Efficiency in Virtual Screening: Identification of New Putative LXRβ Regulators As a Test Case
inferred← citeshttps://doi.org/10.1021/jm701519hopenalex-snapshot
Identification of Novel Cannabinoid CB1 Receptor Antagonists by Using Virtual Screening with a Pharmacophore Model
inferred← citeshttps://doi.org/10.1039/9781847558879-00076openalex-snapshot
Pharmacophore-based Virtual Screening in Drug Discovery
inferred← citeshttps://doi.org/10.1039/c3ra40685gopenalex-snapshot
Ligand based 3D-QSAR modelling studies on 2-amino-6-aryl sulfonylbenzonitriles (AASBNs) as non-nucleoside reverse transcriptase inhibitors of HIV-1
inferred← citeshttps://doi.org/10.1039/c6ra01071gopenalex-snapshot
Molecular modeling of Plasmodium falciparum peptide deformylase and structure-based pharmacophore screening for inhibitors
inferred← citeshttps://doi.org/10.1071/ch09463openalex-snapshot
Binding Mode Prediction of PDE4 Inhibitors: A Comparison of Modelling Methods
inferred← citeshttps://doi.org/10.1080/07391102.2023.2183714openalex-snapshot
Identification of novel human nicotinamide N-methyltransferase inhibitors: a structure-based pharmacophore modeling and molecular dynamics approach
inferred← citeshttps://doi.org/10.1080/1062936x.2011.569948openalex-snapshot
New QSAR prediction models derived from GPCR CB2-antagonistic triaryl bis-sulfone analogues by a combined molecular morphological and pharmacophoric approach
inferred← citeshttps://doi.org/10.1111/cbdd.12950openalex-snapshot
In silico approaches and chemical space of anti‐P‐type ATPase compounds for discovering new antituberculous drugs
inferred← citeshttps://doi.org/10.1186/s13321-019-0371-6openalex-snapshot
Accuracy evaluation and addition of improved dihedral parameters for the MMFF94s
inferred← citeshttps://doi.org/10.1371/journal.pone.0048942openalex-snapshot
Identification of Novel HIV 1- Protease Inhibitors: Application of Ligand and Structure Based Pharmacophore Mapping and Virtual Screening
inferred← citeshttps://doi.org/10.1517/17460441003592072openalex-snapshot
Pharmacophore-based virtual screening: a review of recent applications
inferred← citeshttps://doi.org/10.2174/1386207323666200117102316openalex-snapshot
Computer-aided Drug Design Investigations for Benzothiazinone Derivatives Against Tuberculosis
inferred← citeshttps://doi.org/10.2174/1568026611313090006openalex-snapshot
Methods and Applications of Structure Based Pharmacophores in Drug Discovery
inferred← citeshttps://doi.org/10.2174/1568026615666150813150433openalex-snapshot
Novel HIV-1 Integrase Inhibitor Development by Virtual Screening Based on QSAR Models
inferred← citeshttps://doi.org/10.3389/fchem.2021.775513openalex-snapshot
Accurate Prediction of Inhibitor Binding to HIV-1 Protease Using CANDOCK
Editorial review for independent work. ICSAC — the Institute for Complexity
Science and Advanced Computing — runs a structured editorial panel for researchers
publishing outside journals, and publishes on CiteStamp rails. Submission is free
and goes through ORCID: icsacinstitute.org/submit.