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EADock: Docking of small molecules into protein active sites with a multiobjective evolutionary optimization
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Outgoing claims: the papers this work cites, builds on, or argues with.
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Merck molecular force field. I. Basis, form, scope, parameterization, and performance of MMFF94
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Merck molecular force field. II. MMFF94 van der Waals and electrostatic parameters for intermolecular interactions
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Merck molecular force field. III. Molecular geometries and vibrational frequencies for MMFF94
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Merck molecular force field. IV. conformational energies and geometries for MMFF94
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Merck molecular force field. V. Extension of MMFF94 using experimental data, additional computational data, and empirical rules
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Assessing energy functions for flexible docking
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Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function
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Flexible docking using tabu search and an empirical estimate of binding affinity
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DARWIN: A program for docking flexible molecules
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New analytic approximation to the standard molecular volume definition and its application to generalized Born calculations
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Detailed analysis of grid‐based molecular docking: A case study of CDOCKER—A CHARMm‐based MD docking algorithm
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UCSF Chimera—A visualization system for exploratory research and analysis
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The MPSim‐Dock hierarchical docking algorithm: Application to the eight trypsin inhibitor cocrystals
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CHARMM : A program for macromolecular energy, minimization, and dynamics calculations
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A detailed comparison of current docking and scoring methods on systems of pharmaceutical relevance
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Comparing protein–ligand docking programs is difficult
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Study of the insulin dimerization: Binding free energy calculations and per‐residue free energy decomposition
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A method for localizing ligand binding pockets in protein structures
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PSI‐DOCK: Towards highly efficient and accurate flexible ligand docking
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On the nature of cavities on protein surfaces: Application to the identification of drug‐binding sites
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Polar hydrogen positions in proteins: Empirical energy placement and neutron diffraction comparison
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Development and validation of a genetic algorithm for flexible docking 1 1Edited by F. E. Cohen
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FlexE: efficient molecular docking considering protein structure variations
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A knowledge-based scoring function for protein-ligand interactions: Probing the reference state
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FLOG: A system to select ?quasi-flexible? ligands complementary to a receptor of known three-dimensional structure
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The development of a simple empirical scoring function to estimate the binding constant for a protein-ligand complex of known three-dimensional structure
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A rapid approximation to the solvent accessible surface areas of atoms
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Conformational Diversity of Ligands Bound to Proteins
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Insights into Protein–Protein Binding by Binding Free Energy Calculation and Free Energy Decomposition for the Ras–Raf and Ras–RalGDS Complexes
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Hammerhead: fast, fully automated docking of flexible ligands to protein binding sites
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Free Energy Simulations Come of Age: Protein−Ligand Recognition
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CRYSTAL STRUCTURES OF METYRAPONE-AND PHENYLIMIDAZOLE-INHIBITED COMPLEXES OF CYTOCHROME P450-CAM
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On Evaluating Molecular-Docking Methods for Pose Prediction and Enrichment Factors
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Free energy calculations: Applications to chemical and biochemical phenomena
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Solubility of nonelectrolytes in polar solvents. V. Estimation of the solubility of aliphatic monofunctional compounds in water using a molecular surface area approach
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Theory of hydrophobic bonding. II. Correlation of hydrocarbon solubility in water with solvent cavity surface area
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Semianalytical treatment of solvation for molecular mechanics and dynamics
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Structure Activity Relationship by NMR and by Computer: A Comparative Study
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VALIDATE: A New Method for the Receptor-Based Prediction of Binding Affinities of Novel Ligands
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A priori prediction of activity for HIV-1 protease inhibitors employing energy minimization in the active site
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Assessing Scoring Functions for Protein−Ligand Interactions
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Glide: A New Approach for Rapid, Accurate Docking and Scoring. 1. Method and Assessment of Docking Accuracy
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Discovery of Cell-Permeable Non-Peptide Inhibitors of β-Secretase by High-Throughput Docking and Continuum Electrostatics Calculations
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Comparative Binding Energy Analysis of HIV-1 Protease Inhibitors: Incorporation of Solvent Effects and Validation as a Powerful Tool in Receptor-Based Drug Design
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A General and Fast Scoring Function for Protein−Ligand Interactions: A Simplified Potential Approach
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All-Atom Empirical Potential for Molecular Modeling and Dynamics Studies of Proteins
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Prediction of binding constants of protein ligands: A fast method for the prioritization of hits obtained from de novo design or 3D database search programs
inferredcites →https://doi.org/10.1023/a:1008729005958openalex-snapshot
A knowledge-based scoring function for protein-ligand interactions: Probing the reference state
inferredcites →https://doi.org/10.1023/a:1011115820450openalex-snapshot
DOCK 4.0: Search strategies for automated molecular docking of flexible molecule databases
inferredcites →https://doi.org/10.1023/b:jcam.0000017496.76572.6fopenalex-snapshot
Comparative study of several algorithms for flexible ligand docking
inferredcites →https://doi.org/10.1038/nrd1549openalex-snapshot
Docking and scoring in virtual screening for drug discovery: methods and applications
inferredcites →https://doi.org/10.1073/pnas.181147798openalex-snapshot
Protein docking along smooth association pathways
inferredcites →https://doi.org/10.1074/mcp.m400159-mcp200openalex-snapshot
Pocketome via Comprehensive Identification and Classification of Ligand Binding Envelopes
inferredcites →https://doi.org/10.1515/bc.2001.168openalex-snapshot
Fragment-Based Flexible Ligand Docking by Evolutionary Optimization
inferredcites →https://doi.org/10.5860/choice.27-0936openalex-snapshot
Genetic algorithms in search, optimization, and machine learning
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Docking and Scoring in Drug Discovery
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Rational Design of 4-Aryl-1,2,3-Triazoles for Indoleamine 2,3-Dioxygenase 1 Inhibition
inferred← citeshttps://doi.org/10.1021/jm301819kopenalex-snapshot
Small Molecule Antivirulents Targeting the Iron-Regulated Heme Oxygenase (HemO) ofP. aeruginosa
inferred← citeshttps://doi.org/10.1021/jm9014718openalex-snapshot
Rational Design of Indoleamine 2,3-Dioxygenase Inhibitors
inferred← citeshttps://doi.org/10.1038/s41467-019-10860-3openalex-snapshot
MFS transporter from Botrytis cinerea provides tolerance to glucosinolate-breakdown products and is required for pathogenicity
inferred← citeshttps://doi.org/10.1038/s41598-017-06453-zopenalex-snapshot
Identification of a Flavonoid Glucosyltransferase Involved in 7-OH Site Glycosylation in Tea plants (Camellia sinensis)
inferred← citeshttps://doi.org/10.1038/s41598-018-25336-5openalex-snapshot
Analysis of β-tubulin-carbendazim interaction reveals that binding site for MBC fungicides does not include residues involved in fungicide resistance
inferred← citeshttps://doi.org/10.1038/s41598-020-66624-3openalex-snapshot
Blood pressure-lowering effects of a Bowman-Birk inhibitor and its derived peptides in normotensive and hypertensive rats
inferred← citeshttps://doi.org/10.1038/s41598-020-74536-5openalex-snapshot
Molecular simulations unravel the molecular principles that mediate selective permeability of carboxysome shell protein
inferred← citeshttps://doi.org/10.1038/s42003-024-06947-3openalex-snapshot
Cyclo(Pro-Tyr) elicits conserved cellular damage in fungi by targeting the [H+]ATPase Pma1 in plasma membrane domains
inferred← citeshttps://doi.org/10.1038/sj.bjp.0707515openalex-snapshot
Towards the development of universal, fast and highly accurate docking/scoring methods: a long way to go
inferred← citeshttps://doi.org/10.1039/9781788012911-00222openalex-snapshot
Modeling O2-dependent Heme Enzymes: A Quick Guide for Non-experts
inferred← citeshttps://doi.org/10.1039/9781849735377-00195openalex-snapshot
Binding Free Energy Calculation and Scoring in Small-Molecule Docking
inferred← citeshttps://doi.org/10.1039/d0md00182aopenalex-snapshot
Fenretinide binding to the lysosomal protein saposin D alters ceramide solubilization and hydrolysis
inferred← citeshttps://doi.org/10.1039/d0sc00954gopenalex-snapshot
Inhibiting cancer metabolism by aromatic carbohydrate amphiphiles that act as antagonists of the glucose transporter GLUT1
inferred← citeshttps://doi.org/10.1063/1.3173809openalex-snapshot
Further analysis and comparative study of intermolecular interactions using dimers from the S22 database
inferred← citeshttps://doi.org/10.1063/1.4944305openalex-snapshot
Assessment of some pesticides interactions with human cytochrome P450: CYP2C8, CYP2C9 and CYP2C19 by molecular docking approach
inferred← citeshttps://doi.org/10.1063/1.5109983openalex-snapshot
In silico analysis of bioactive compounds of Hibiscus sabdariffa as potential agonists of LXR to inhibit the atherogenesis process
inferred← citeshttps://doi.org/10.1080/07391102.2011.10507384openalex-snapshot
BetaDock: Shape-Priority Docking Method Based on Beta-Complex
inferred← citeshttps://doi.org/10.1080/07391102.2023.2169762openalex-snapshot
Highlights in TMPRSS2 inhibition mechanism with guanidine derivatives approved drugs for COVID-19 treatment
inferred← citeshttps://doi.org/10.1080/17460913.2026.2633082openalex-snapshot
Pharmacokinetics, quantum chemistry, and molecular modeling analysis of six potential drug candidates for Chagas disease: posaconazole, K777, phenarimol derivative, BZTS, isoxazole analog, and derivative of 4-arylaminonoline-3-carbonitrile
inferred← citeshttps://doi.org/10.1093/bib/bbaa034openalex-snapshot
Virtual screening web servers: designing chemical probes and drug candidates in the cyberspace
inferred← citeshttps://doi.org/10.1093/hmg/ddt217openalex-snapshot
Pharmacological chaperones as a potential therapeutic option in methylmalonic aciduria cblB type
inferred← citeshttps://doi.org/10.1099/mic.0.000138openalex-snapshot
Permissivity of the biphenyl-specific aerobic bacterial metabolic pathway towards analogues with various steric requirements
inferred← citeshttps://doi.org/10.1101/2020.03.26.009803openalex-snapshot
The potential SARS-CoV-2 entry inhibitor
inferred← citeshttps://doi.org/10.1101/2020.08.17.20176891openalex-snapshot
Blood donor exposome and impact of common drugs on red blood cell metabolism
inferred← citeshttps://doi.org/10.1101/2021.05.04.442442openalex-snapshot
CFTR corrector efficacy is associated with occupancy of distinct binding sites
inferred← citeshttps://doi.org/10.1101/2025.02.06.636830openalex-snapshot
The offensive role of the Bacillus extracellular matrix in driving metabolite-mediated dialogue and adaptive strategies with pathogenic fungi
inferred← citeshttps://doi.org/10.1109/cec60901.2024.10612023openalex-snapshot
A Survey of Applications of Multi-Objective Evolutionary Algorithms in Biotechnology
inferred← citeshttps://doi.org/10.1109/iscon52037.2021.9702407openalex-snapshot
Regulation of Hypoxia Inducible Factor via Histone Deacetylase 3 Inhibitor Valproic Acid: A computational Study between HIF-1a, Histone Deacetylase, and Valproic Acid
inferred← citeshttps://doi.org/10.1109/tevc.2022.3225632openalex-snapshot
AutoDock Koto: A Gradient Boosting Differential Evolution for Molecular Docking
inferred← citeshttps://doi.org/10.1109/tevc.2024.3382145openalex-snapshot
A Survey on Evolutionary Computation-Based Drug Discovery
inferred← citeshttps://doi.org/10.1111/j.1582-4934.2008.00665.xopenalex-snapshot
Docking, virtual high throughput screening and in silico fragment‐based drug design
inferred← citeshttps://doi.org/10.1111/j.1582-4934.2008.00666.xopenalex-snapshot
A new era for small molecule screening: from new targets, such as JAK2 V617F, to complex cellular screens
inferred← citeshttps://doi.org/10.1124/molpharm.123.000843openalex-snapshot
Intracellular Allosteric Antagonist of the Olfactory Receptor OR51E2
inferred← citeshttps://doi.org/10.1128/jvi.01651-10openalex-snapshot
Structure-Function Analyses Point to a Polynucleotide-Accommodating Groove Essential for APOBEC3A Restriction Activities
inferred← citeshttps://doi.org/10.1134/s0003683824605912openalex-snapshot
Biologically Active Quinolinone Alkaloid from the Marine Fungus Penicillium polonicum KMM 4719
inferred← citeshttps://doi.org/10.1142/9789812778789_0025openalex-snapshot
Docking for Neglected Diseases as Community Efforts
inferred← citeshttps://doi.org/10.1142/9789812838780_0009openalex-snapshot
Protein Structure Modeling and Docking at the Swiss Institute of Bioinformatics
inferred← citeshttps://doi.org/10.1142/9789812838780_0010openalex-snapshot
Molecular Modeling of Proteins: From Simulations to Drug Design Applications
inferred← citeshttps://doi.org/10.1145/1646461.1646462openalex-snapshot
FPGA-based acceleration of CHARMM-potential minimization
inferred← citeshttps://doi.org/10.1155/2018/8613209openalex-snapshot
Inhibition of Protein Aggregation by Several Antioxidants
inferred← citeshttps://doi.org/10.11606/t.76.2009.tde-23042009-145454openalex-snapshot
Planejamento racional de novos agentes quimioterápicos: Identificação e estudos cinéticos de novos inibidores da gliceraldeído-3-fosfato desidrogenase glicossomal de Trypanosoma cruzi
inferred← citeshttps://doi.org/10.1172/jci.insight.146175openalex-snapshot
Blood donor exposome and impact of common drugs on red blood cell metabolism
inferred← citeshttps://doi.org/10.1186/1471-2105-10-101openalex-snapshot
Cyndi: a multi-objective evolution algorithm based method for bioactive molecular conformational generation
inferred← citeshttps://doi.org/10.1186/1471-2105-10-58openalex-snapshot
An effective docking strategy for virtual screening based on multi-objective optimization algorithm
inferred← citeshttps://doi.org/10.1186/1471-2105-13-s17-s7openalex-snapshot
Sanjeevini: a freely accessible web-server for target directed lead molecule discovery
inferred← citeshttps://doi.org/10.1186/2193-9616-1-11openalex-snapshot
Inhibition of VEGF: a novel mechanism to control angiogenesis by Withania somnifera’s key metabolite Withaferin A
inferred← citeshttps://doi.org/10.1186/s12915-022-01464-3openalex-snapshot
AHL-Priming Protein 1 mediates N-3-oxo-tetradecanoyl-homoserine lactone priming in Arabidopsis
inferred← citeshttps://doi.org/10.13005/bbra/3198openalex-snapshot
The Emergence of In-Silico Models in Drug Target Interaction System: A Comprehensive Review
inferred← citeshttps://doi.org/10.1371/journal.pone.0116248openalex-snapshot
Histidine 352 (His352) and Tryptophan 355 (Trp355) Are Essential for Flax UGT74S1 Glucosylation Activity toward Secoisolariciresinol
inferred← citeshttps://doi.org/10.14233/ajchem.2019.21956openalex-snapshot
in silico Evaluation of 4-Amino-5-substituted-4H-1,2,4-triazole-3-thiol Derivatives against DNA Gyrase, COX-2 and Cathepsin B
inferred← citeshttps://doi.org/10.1515/eces-2015-0025openalex-snapshot
Effects Of Herbicides And Fungicides On The Soil Chitinolytic Activity. A Molecular Docking Approach
inferred← citeshttps://doi.org/10.1517/17460441.2013.794780openalex-snapshot
Automated docking for novel drug discovery
inferred← citeshttps://doi.org/10.15252/embj.2021110550openalex-snapshot
Cryo‐EM reveals mechanisms of angiotensin I‐converting enzyme allostery and dimerization
inferred← citeshttps://doi.org/10.15302/j-qb-022-0321openalex-snapshot
Exploration on learning molecular docking with deep learning models
inferred← citeshttps://doi.org/10.15625/2525-2518/59/4/16003openalex-snapshot
VIRTUAL SCREENING STATEGIES IN DRUG DISCOVERY – A BRIEF OVERVIEW
inferred← citeshttps://doi.org/10.21203/rs.3.rs-1345959/v1openalex-snapshot
Deciphering β-tubulin gene of carbendazim resistant Fusarium solani isolate and its comparison with other Fusarium species
inferred← citeshttps://doi.org/10.21203/rs.3.rs-23956/v1openalex-snapshot
Antiviral potential of phytoligands against chymotrypsin-like protease of COVID‐19 virus using molecular docking studies: An optimistic approach
inferred← citeshttps://doi.org/10.21203/rs.3.rs-38145/v1openalex-snapshot
Anti- SARS-CoV-2 main protease complex (Mpro) activity of Palmatine
inferred← citeshttps://doi.org/10.21203/rs.3.rs-5449722/v1openalex-snapshot
Diphenhydramine-mediated modulation of inward rectifier IK1 current induces conduction blocks in the rat pulmonary veins myocardium and facilitates supraventricular proarrhythmicity
inferred← citeshttps://doi.org/10.2147/dddt.s209324openalex-snapshot
Evaluation of novel pyrimidine derivatives as a new class of mushroom tyrosinase inhibitor
inferred← citeshttps://doi.org/10.2174/0127724344313755241021055002openalex-snapshot
Deciphering Plasmodium Condensin Core Subunits of Structural Maintenance of Chromosomes 2 (SMC2) as a Putative Drug Target for Antimalarial Drug
inferred← citeshttps://doi.org/10.2174/0929867311320180002openalex-snapshot
Protein-Ligand Docking in the New Millennium – A Retrospective of 10 Years in the Field
inferred← citeshttps://doi.org/10.2174/09298673113209990001openalex-snapshot
Virtual Screening Strategies in Drug Discovery: A Critical Review
inferred← citeshttps://doi.org/10.2174/138620711795767811openalex-snapshot
Comparative Modeling: The State of the Art and Protein Drug Target Structure Prediction
inferred← citeshttps://doi.org/10.2174/156802612804547371openalex-snapshot
Computational Tools for In Silico Fragment-Based Drug Design
inferred← citeshttps://doi.org/10.2174/157340909787580863openalex-snapshot
Computational Intelligence Methods for Docking Scores
inferred← citeshttps://doi.org/10.2174/157489308784340694openalex-snapshot
Integrating Bioinformatics and Computational Biology: Perspectives and Possibilities for In Silico Network Reconstruction in Molecular Systems Biology
inferred← citeshttps://doi.org/10.22159/ijpps.2017v9i8.19835openalex-snapshot
IN SILICO STUDIES ON FUNCTIONALIZED AZAGLYCINE DERIVATIVES CONTAINING 2, 4-THIAZOLIDINEDIONE SCAFFOLD ON MULTIPLE TARGETS
inferred← citeshttps://doi.org/10.30574/ijsra.2022.7.2.0257openalex-snapshot
Mode of action of vinca alkaloids against cancer using Insilco analysis technique
inferred← citeshttps://doi.org/10.31219/osf.io/chvsaopenalex-snapshot
SARS - CoV - 2 Attachment to Host Cells is Possibly Mediated via RGD - Inte grin Interaction in a Calcium - dependent Manner
inferred← citeshttps://doi.org/10.31219/osf.io/q96cropenalex-snapshot
Anti- SARS-CoV-2 main protease complex (Mpro) activity of Palmatine
inferred← citeshttps://doi.org/10.31276/vjste.2023.0041openalex-snapshot
Association between HLA-DQB1, -DPB1 alleles and risk of carbamazepine-induced hypersensitivity reactions in Vietnamese patients with epilepsy
inferred← citeshttps://doi.org/10.31965/infokes.vol21.iss1.965openalex-snapshot
In Silico Analysis of the NPC1L1 Inhibitor of Catechins from Green Tea
inferred← citeshttps://doi.org/10.32657/10356/69603openalex-snapshot
Exploiting receptor flexibility to improve the accuracy of structure-based virtual screening
inferred← citeshttps://doi.org/10.3389/fchem.2018.00188openalex-snapshot
Quantum Chemical Approaches in Structure-Based Virtual Screening and Lead Optimization
inferred← citeshttps://doi.org/10.3389/fmolb.2021.716466openalex-snapshot
SeamDock: An Interactive and Collaborative Online Docking Resource to Assist Small Compound Molecular Docking
inferred← citeshttps://doi.org/10.3389/fphar.2020.01253openalex-snapshot
The C-C Chemokine Receptor Type 4 Is an Immunomodulatory Target of Hydroxychloroquine
inferred← citeshttps://doi.org/10.3390/agriculture11060469openalex-snapshot
Assessment of the Effect of Application of the Herbicide S-Metolachlor on the Activity of Some Enzymes Found in Soil
inferred← citeshttps://doi.org/10.3390/agronomy11091702openalex-snapshot
Impact of the Herbicide Oxyfluorfen on the Activities of Some Enzymes Found in Soil and on the Populations of Soil Microorganisms
inferred← citeshttps://doi.org/10.3390/antiox11050972openalex-snapshot
Nitro-Oleic Acid-Mediated Nitroalkylation Modulates the Antioxidant Function of Cytosolic Peroxiredoxin Tsa1 during Heat Stress in Saccharomyces cerevisiae
inferred← citeshttps://doi.org/10.3390/biomedicines9060681openalex-snapshot
Estrogen-Like Effect of Mitotane Explained by Its Agonist Activity on Estrogen Receptor-α
inferred← citeshttps://doi.org/10.3390/biomedinformatics6030029openalex-snapshot
A Comparative Dual-Platform Docking and Dynamic Light Scattering Analysis of Nutraceutical Interactions with the ApoE4–oxLDL Complex
inferred← citeshttps://doi.org/10.3390/cancers12040864openalex-snapshot
Utilizing Genome-Wide mRNA Profiling to Identify the Cytotoxic Chemotherapeutic Mechanism of Triazoloacridone C-1305 as Direct Microtubule Stabilization
inferred← citeshttps://doi.org/10.3390/ijms11083016openalex-snapshot
Advances and Challenges in Protein-Ligand Docking
inferred← citeshttps://doi.org/10.3390/ijms19103273openalex-snapshot
Structural Analysis of Variability and Interaction of the N-terminal of the Oncogenic Effector CagA of Helicobacter pylori with Phosphatidylserine
inferred← citeshttps://doi.org/10.3390/md18110545openalex-snapshot
Recent Advances in Molecular Docking for the Research and Discovery of Potential Marine Drugs
inferred← citeshttps://doi.org/10.3390/metabo11030190openalex-snapshot
The Interaction of the Flavonoid Fisetin with Human Glutathione Transferase A1-1
inferred← citeshttps://doi.org/10.3390/molecules20058997openalex-snapshot
S4MPLE—Sampler for Multiple Protein-Ligand Entities: Methodology and Rigid-Site Docking Benchmarking
inferred← citeshttps://doi.org/10.3390/molecules200610154openalex-snapshot
Solving Molecular Docking Problems with Multi-Objective Metaheuristics
inferred← citeshttps://doi.org/10.3390/molecules200713384openalex-snapshot
Molecular Docking and Structure-Based Drug Design Strategies
inferred← citeshttps://doi.org/10.3390/molecules21111575openalex-snapshot
Molecular Docking Optimization in the Context of Multi-Drug Resistant and Sensitive EGFR Mutants
inferred← citeshttps://doi.org/10.3390/molecules23102627openalex-snapshot
In-Silico Prediction and Modeling of the Quorum Sensing LuxS Protein and Inhibition of AI-2 Biosynthesis in Aeromonas hydrophila
inferred← citeshttps://doi.org/10.3390/molecules26082399openalex-snapshot
The Interaction of Human Glutathione Transferase GSTA1-1 with Reactive Dyes
inferred← citeshttps://doi.org/10.3390/molecules26164957openalex-snapshot
Anti-Cancer Potential of Synthetic Oleanolic Acid Derivatives and Their Conjugates with NSAIDs
inferred← citeshttps://doi.org/10.3390/molecules27144623openalex-snapshot
Open-Source Browser-Based Tools for Structure-Based Computer-Aided Drug Discovery
inferred← citeshttps://doi.org/10.3390/molecules28104123openalex-snapshot
Identification of Some Glutamic Acid Derivatives with Biological Potential by Computational Methods
inferred← citeshttps://doi.org/10.3390/molecules28186748openalex-snapshot
Evaluation of the Toxicity Potential of the Metabolites of Di-Isononyl Phthalate and of Their Interactions with Members of Family 1 of Sulfotransferases—A Computational Study
inferred← citeshttps://doi.org/10.3390/molecules29174119openalex-snapshot
Investigating the Antimicrobial Properties of Essential Oil Constituents and Their Mode of Action
inferred← citeshttps://doi.org/10.3390/oxygen3040024openalex-snapshot
The Kelch/Nrf2 Antioxidant System as a Target for Some Marine Fungal Metabolites
inferred← citeshttps://doi.org/10.3390/plants12061245openalex-snapshot
A Comprehensive Review on Cannabis sativa Ethnobotany, Phytochemistry, Molecular Docking and Biological Activities
inferred← citeshttps://doi.org/10.34626/0hnm-hn65openalex-snapshot
New Computational Methods to Calculate Drug-Receptor Binding Free Energies
inferred← citeshttps://doi.org/10.35118/apjmbb.2019.027.3.01openalex-snapshot
The identification of SNPs in THCA synthase gene from Pakistani Cannabis
inferred← citeshttps://doi.org/10.35652/igjps.2022.12006openalex-snapshot
A Review on Computational Software Tools for Drug Design and Discovery
inferred← citeshttps://doi.org/10.4014/jmb.1910.10037openalex-snapshot
Two flavonoid-based compounds from Murraya paniculata as novel human carbonic anhydrase isozyme II inhibitors detected by a resazurin yeast-based assay
inferred← citeshttps://doi.org/10.4018/978-1-5225-0115-2.ch015openalex-snapshot
Online Molecular Docking Resources
inferred← citeshttps://doi.org/10.4018/978-1-5225-0549-5.ch037openalex-snapshot
Online Molecular Docking Resources
inferred← citeshttps://doi.org/10.4018/978-1-5225-2325-3.ch002openalex-snapshot
Implications of Molecular Docking Assay for Bioremediation
inferred← citeshttps://doi.org/10.4018/978-1-7998-1204-3.ch078openalex-snapshot
Implications of Molecular Docking Assay for Bioremediation
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