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Application

Discovery Studio 0.9065268588090165 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06942301758716446 Amorphous Cell 0.283168775069423 Blends 0.002776920703486578 CASTEP 0.4269515581610614 CDOCKER 0.1613699475470534 CHARMm 0.24105214439987657 COMPASS 0.38306078370873187 COMPASS III 0.0755939524838013 COSMObase 0.0029311940759024994 COSMOconf 0.003394014193150262 COSMOmic 2.3141005862388153E-4 COSMOperm 0.0013113236655353285 COSMOplex 3.08546744831842E-4 COSMOquick 0.0014655970379512497 COSMOtherm 0.06494908978710275 Cantera 7.71366862079605E-5 Catalyst 0.11879049676025918 Classical Simulations 1.0 Conformers 0.0011570502931194076 Crystallization 0.07744523295279235 DFTB Plus 0.00609379821042888 DMol3 0.1955414995371799 DPD 0.0032397408207343412 Discover 0.005091021289725393 Forcite 0.5448164146868251 GULP 0.02746066029003394 Kinetix 2.3141005862388153E-4 LUDI 0.004782474544893551 LibDock 0.06618327676643011 LigandFit 0.00609379821042888 MCSS 9.256402344955261E-4 MODELER 0.16985498302992905 MesoDyn 0.0016198704103671706 Mesocite 0.004396791113853749 Mesoscale 0.008022215365627893 Modules 0.0 Morphology 0.017895711200246838 ONETEP 0.001234186979327368 Polymorph 0.0020055538414069734 QMERA 2.3141005862388153E-4 QSAR 0.0015427337241592102 Quantum Mechanics 0.6095340944153039 Reflex 0.057158284480098735 Reflex Plus 6.942301758716445E-4 Semi-empirical 0.008253625424251775 Sorption 0.055615550755939526 Synthia 0.0014655970379512497 TURBOMOLE 5.399568034557236E-4 VAMP 0.0017741437827830915 Visualization 0.8174174637457575 X-Cell 0.001234186979327368 ZDOCK 0.027923480407281702

Year

2020 0.0 2021 0.06138714600644395 2022 0.2847210445989486 2023 0.42402916737324065 2024 1.0 2025 0.9704934712565711 2026 0.36120061047990504 2027 7.63099881295574E-4

Keywords

target 1.0 potential 0.25675180658696595 docking 0.19910752938825801 visualization 0.1934463352092977 analysis 0.17536381497885378 between 0.15481701022345065 novel 0.09470844849978355 energy 0.09054580572113624 binding 0.06057477771487562 cell 0.059109527456791766 promising 0.04385760431582803 activity 0.043424689466848715 interaction 0.036531353025408775 experimental 0.03223550567784475 stability 0.029071897166072797 synthesized 0.026541010356655233 performance 0.02244496986246628 mechanism 0.01711678710579773 effective 0.016883679110193478 development 0.013553564887275634 protein 0.00995704152652436 synthesis 0.009024609544107363 including 0.008158779846148724 chemical 0.003596523360751274 design 0.0
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