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Application

Discovery Studio 1.0 Materials Studio 0.25124172185430466 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.11120917917034422 Amorphous Cell 0.06884377758164166 Blends 0.0 CASTEP 0.02736098852603707 CDOCKER 0.41924095322153576 CHARMm 0.5684024713150927 COMPASS 0.3177405119152692 COMPASS III 0.00441306266548985 COSMOperm 0.0 COSMOtherm 0.01323918799646955 Catalyst 0.5039717563989409 Classical Simulations 1.0 Conformers 0.00353045013239188 Crystallization 0.01323918799646955 DFTB Plus 0.00353045013239188 DMol3 0.12533097969991175 DPD 8.8261253309797E-4 Discover 0.02471315092674316 Forcite 0.2621359223300971 GULP 0.00441306266548985 LUDI 0.02559576345984113 LibDock 0.1147396293027361 LigandFit 0.1059135039717564 MCSS 0.00353045013239188 MODELER 0.45984112974404234 Mesoscale 8.8261253309797E-4 Morphology 0.00441306266548985 ONETEP 8.8261253309797E-4 QSAR 0.00706090026478376 Quantum Mechanics 0.15357458075904679 Reflex 0.00617828773168579 Reflex Plus 8.8261253309797E-4 Semi-empirical 0.01676963812886143 Sorption 0.00617828773168579 VAMP 0.01235657546337158 Visualization 0.793468667255075 X-Cell 0.00176522506619594 ZDOCK 0.04148278905560459

Year

2002 0.0 2003 0.0 2004 0.002967359050445104 2005 0.005934718100890208 2006 0.020771513353115726 2007 0.011869436201780416 2008 0.07418397626112759 2009 0.10089020771513353 2010 0.20474777448071216 2011 0.06528189910979229 2012 0.04154302670623145 2013 0.3798219584569733 2014 0.5608308605341247 2015 0.7566765578635015 2016 0.8249258160237388 2017 0.9792284866468842 2018 0.7062314540059347 2019 0.9376854599406528 2020 1.0 2021 0.8397626112759644 2022 0.5934718100890207 2023 0.5014836795252225 2024 0.20178041543026706 2025 0.21364985163204747 2026 0.017804154302670624

Keywords

inhibition 1.0 target 0.9621363092865683 docking 0.33997608609007574 potential 0.21323236349143085 activity 0.1881227580709446 novel 0.15225189318453566 inhibitor 0.1351135910721403 visualization 0.1351135910721403 binding 0.12036667995217218 compound 0.09246711837385413 potent 0.08449581506576326 vitro 0.07174172977281786 synthesized 0.06815464328417696 analysis 0.06656038262255878 inhibitory 0.05579912315663611 enzyme 0.04982064567556795 between 0.046632124352331605 synthesis 0.04264647269828617 medicinal 0.012754085292945397 human 0.011956954962136309 catalyst 0.010761259465922678 protein 0.010761259465922678 drug 0.005579912315663611 development 3.9856516540454366E-4 interaction 0.0
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