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Application

Discovery Studio 1.0 Materials Studio 0.41051817478731634 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04690949227373068 Amorphous Cell 0.10347682119205298 Antibody 2.759381898454746E-4 Blends 8.278145695364238E-4 CASTEP 0.2902869757174393 CDOCKER 0.2488962472406181 CHARMm 0.36120309050772625 COMPASS 0.16583885209713023 COMPASS III 0.03228476821192053 COSMObase 0.002207505518763797 COSMOconf 0.0024834437086092716 COSMOperm 0.0011037527593818985 COSMOquick 5.518763796909492E-4 COSMOtherm 0.05491169977924945 Cantera 0.0 Catalyst 0.20833333333333334 Classical Simulations 0.7110927152317881 Conformers 0.0011037527593818985 Crystallization 0.035044150110375274 DFTB Plus 0.0033112582781456954 DMol3 0.13245033112582782 DPD 0.0016556291390728477 Discover 0.0033112582781456954 Forcite 0.22847682119205298 GULP 0.018763796909492272 Kinetix 5.518763796909492E-4 LUDI 0.009657836644591612 LibDock 0.10623620309050773 LigandFit 0.016280353200883002 MCSS 0.0016556291390728477 MODELER 0.28394039735099336 MesoDyn 5.518763796909492E-4 Mesocite 0.0 Mesoscale 0.0024834437086092716 Morphology 0.008278145695364239 ONETEP 0.002207505518763797 Polymorph 0.0016556291390728477 QMERA 5.518763796909492E-4 QSAR 0.0016556291390728477 Quantum Mechanics 0.4141832229580574 Reflex 0.024834437086092714 Semi-empirical 0.0063465783664459164 Sorption 0.029525386313465785 Synthia 2.759381898454746E-4 TURBOMOLE 2.759381898454746E-4 VAMP 0.0019315673289183224 Visualization 1.0 X-Cell 5.518763796909492E-4 ZDOCK 0.03145695364238411

Year

2015 0.0 2016 0.011614401858304297 2017 0.09059233449477352 2018 0.11304684475416182 2019 0.1397599690282617 2020 0.17228029423151375 2021 0.2497096399535424 2022 0.3948896631823461 2023 0.5547812620983352 2024 0.7986837011227255 2025 1.0 2026 0.2353852109949671 2027 3.8714672861014324E-4

Keywords

potential 1.0 target 0.9597722490407229 docking 0.3608119816809011 visualization 0.24743161282336923 analysis 0.2263894046292858 binding 0.13145191236539175 novel 0.1283574699839089 activity 0.09283327144448571 promising 0.07290506250773611 between 0.0719148409456616 protein 0.060651070677063997 drug 0.05012996658002228 silico 0.0363906424062384 vitro 0.03453397697734868 therapeutic 0.030077979948013367 compound 0.028592647604901596 inhibition 0.027973759128605027 treatment 0.022775095927713825 development 0.018690431984156455 interaction 0.014853323431117713 including 0.013739324173783884 synthesized 0.007302884020299542 energy 0.0043322193340759995 stability 0.0016091100383710856 effective 0.0
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