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Application

Discovery Studio 1.0 Materials Studio 0.9946615259138429 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06656286492798755 Amorphous Cell 0.27899961074347995 Blends 0.0023355391202802647 CASTEP 0.38750486570650056 CDOCKER 0.16776956014013233 CHARMm 0.25943947061113276 COMPASS 0.36249513429349944 COMPASS III 0.08223043985986765 COSMObase 0.0036006228104320747 COSMOconf 0.004184507590502141 COSMOmic 9.731413001167769E-5 COSMOperm 0.00126508369015181 COSMOplex 2.919423900350331E-4 COSMOquick 0.0013623978201634877 COSMOtherm 0.0632541845075905 Cantera 0.0 Catalyst 0.12465940054495912 Classical Simulations 1.0 Conformers 6.811989100817438E-4 Crystallization 0.07347216815881666 DFTB Plus 0.0056442195406773065 DMol3 0.17506811989100818 DPD 0.0028221097703386533 Discover 0.00379525107045543 Forcite 0.5327948618139354 GULP 0.024231218372907745 Kinetix 1.9462826002335538E-4 LUDI 0.004184507590502141 LibDock 0.070650058388478 LigandFit 0.005449591280653951 MCSS 5.838847800700662E-4 MODELER 0.18518878941222267 MesoDyn 0.0011677695601401323 Mesocite 0.003989879330478786 Mesoscale 0.0071039314908524715 Modules 0.0 Morphology 0.017808485792137018 ONETEP 0.0010704554301284547 Polymorph 0.0018489684702218763 QMERA 1.9462826002335538E-4 QSAR 0.0010704554301284547 Quantum Mechanics 0.5514791747761775 Reflex 0.0532308291163877 Reflex Plus 8.758271701050993E-4 Semi-empirical 0.007687816270922538 Sorption 0.05537173997664461 Synthia 0.001557026080186843 TURBOMOLE 4.865706500583885E-4 VAMP 0.0016543402101985207 Visualization 0.8416699104710004 X-Cell 0.0013623978201634877 ZDOCK 0.02958349552355002

Year

2021 0.0 2022 0.11946591707659873 2023 0.36647926914968376 2024 0.6793745607870696 2025 1.0 2026 0.37429725931131413 2027 8.784258608573436E-4

Keywords

target 1.0 potential 0.2813188676046788 docking 0.2232157992880149 visualization 0.207492795389049 analysis 0.19147313103915917 between 0.15383963383624344 novel 0.10255975589082895 energy 0.08628581115443296 binding 0.07289371079844041 cell 0.06276487540261061 promising 0.05729784709272758 activity 0.05403458213256484 interaction 0.036658755721308695 stability 0.03615019494829632 synthesized 0.031403627733514156 experimental 0.02928462451262926 performance 0.027292761484997458 protein 0.02089337175792507 development 0.02072385150025428 effective 0.020003390405153417 mechanism 0.019579589760976436 including 0.01729106628242075 synthesis 0.013815901000169521 design 0.0022885234785556875 chemical 0.0
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