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Application

Discovery Studio 1.0 Materials Studio 0.9852124305659811 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06606754888406083 Amorphous Cell 0.27681216669958525 Blends 0.002468891961287774 CASTEP 0.3811969188228323 CDOCKER 0.16966225557969583 CHARMm 0.2619000592534071 COMPASS 0.3594706695634999 COMPASS III 0.08265850286391467 COSMObase 0.003456448745802884 COSMOconf 0.004147738494963461 COSMOmic 9.875567845151097E-5 COSMOperm 0.0012838238198696426 COSMOplex 1.9751135690302193E-4 COSMOquick 0.0013825794983211535 COSMOtherm 0.06241358878135493 Cantera 0.0 Catalyst 0.12443215484890381 Classical Simulations 1.0 Conformers 7.900454276120877E-4 Crystallization 0.0738692474817302 DFTB Plus 0.005530317993284614 DMol3 0.17282243729014418 DPD 0.002468891961287774 Discover 0.003160181710448351 Forcite 0.5333794193166107 GULP 0.023701362828362632 Kinetix 2.962670353545329E-4 LUDI 0.0046415168872210154 LibDock 0.07140035552044242 LigandFit 0.00612285206399368 MCSS 8.888011060635987E-4 MODELER 0.18635196523800118 MesoDyn 0.0010863124629666206 Mesocite 0.003456448745802884 Mesoscale 0.006517874777799724 Modules 0.0 Morphology 0.01747975508591744 ONETEP 9.875567845151097E-4 Polymorph 0.0017776022121271974 QMERA 1.9751135690302193E-4 QSAR 9.875567845151097E-4 Quantum Mechanics 0.5432549871617618 Reflex 0.053920600434524985 Reflex Plus 8.888011060635987E-4 Semi-empirical 0.0073079202054118116 Sorption 0.055895714003555204 Synthia 0.0014813351767726645 TURBOMOLE 5.925340707090658E-4 VAMP 0.0013825794983211535 Visualization 0.8392257554809401 X-Cell 0.0012838238198696426 ZDOCK 0.029330436500098755

Year

2021 0.0 2022 0.1054945054945055 2023 0.3648351648351648 2024 0.6512527472527473 2025 1.0 2026 0.37450549450549453 2027 7.912087912087913E-4

Keywords

target 1.0 potential 0.28290495083663963 docking 0.22485768500948766 visualization 0.20903053303432811 analysis 0.19458340520959116 between 0.15279454890460584 novel 0.10337243401759531 energy 0.08530274279799896 binding 0.0753406934621356 cell 0.06343798516474038 promising 0.059513541486976025 activity 0.05459720545109539 interaction 0.03751940658961532 stability 0.036570639986199756 synthesized 0.031395549422114886 experimental 0.028290495083663963 performance 0.02742797998964982 effective 0.02173538036915646 protein 0.02095911678454373 development 0.020743488011040194 mechanism 0.020614110746938072 including 0.01794031395549422 synthesis 0.015137139899948249 design 0.002975677074348801 chemical 0.0
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