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Application

Discovery Studio 1.0 Materials Studio 0.2237411316836823 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.10522496371552975 Amorphous Cell 0.07002902757619739 Blends 0.0 CASTEP 0.026124818577648767 CDOCKER 0.3570391872278665 CHARMm 0.4564586357039187 COMPASS 0.28410740203193036 COMPASS III 0.011248185776487663 COSMObase 0.0 COSMOperm 3.62844702467344E-4 COSMOtherm 0.01088534107402032 Catalyst 0.37336719883889696 Classical Simulations 0.8461538461538461 Conformers 0.00181422351233672 Crystallization 0.012336719883889695 DFTB Plus 0.003265602322206096 DMol3 0.09760522496371553 DPD 7.25689404934688E-4 Discover 0.02576197387518142 Forcite 0.24274310595065313 GULP 0.003265602322206096 LUDI 0.017053701015965168 LibDock 0.10776487663280115 LigandFit 0.057692307692307696 MCSS 0.00362844702467344 MODELER 0.32982583454281567 Mesocite 3.62844702467344E-4 Mesoscale 0.0010885341074020319 Morphology 0.0047169811320754715 ONETEP 3.62844702467344E-4 QSAR 0.00362844702467344 Quantum Mechanics 0.12227866473149492 Reflex 0.006531204644412192 Reflex Plus 3.62844702467344E-4 Semi-empirical 0.011248185776487663 Sorption 0.006168359941944848 VAMP 0.007619738751814224 Visualization 1.0 X-Cell 0.00181422351233672 ZDOCK 0.02939042089985486

Year

2002 0.0 2003 0.0 2004 0.0011135857461024498 2005 0.0022271714922048997 2006 0.0077951002227171495 2007 0.004454342984409799 2008 0.02783964365256125 2009 0.0378619153674833 2010 0.08351893095768374 2011 0.0779510022271715 2012 0.03897550111358575 2013 0.155902004454343 2014 0.23385300668151449 2015 0.3028953229398664 2016 0.3285077951002227 2017 0.43207126948775054 2018 0.5144766146993318 2019 0.6859688195991092 2020 0.7193763919821826 2021 0.8229398663697105 2022 1.0 2023 0.9409799554565702 2024 0.8006681514476615 2025 0.6447661469933185 2026 0.09020044543429843

Keywords

inhibition 1.0 target 0.9647517369937298 docking 0.41721742077613966 potential 0.29994916115912557 visualization 0.25351635316048127 activity 0.19369598373157093 novel 0.16082019996610744 binding 0.1354007795288934 analysis 0.12913065582104727 inhibitor 0.1226910693102864 vitro 0.10726995424504321 compound 0.10659210303338418 potent 0.09439078122352143 synthesized 0.09354346720894764 inhibitory 0.07286900525334689 synthesis 0.07236061684460261 enzyme 0.06032875783765464 between 0.043213014743263854 protein 0.036265039823758685 drug 0.033723097780037285 treatment 0.018979833926453145 promising 0.013557024233180818 silico 0.012370784612777495 interaction 0.00847314014573801 active 0.0
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