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Application

Discovery Studio 1.0 Materials Studio 0.9852293577981651 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06488230373999283 Amorphous Cell 0.27721352610825667 Blends 0.002389771776795316 CASTEP 0.37579161190106347 CDOCKER 0.16716453578683235 CHARMm 0.264786712868921 COMPASS 0.35129645118891145 COMPASS III 0.09069183892938225 COSMObase 0.004182100609391803 COSMOconf 0.0048990321424303976 COSMOmic 1.194885888397658E-4 COSMOperm 0.001194885888397658 COSMOplex 2.389771776795316E-4 COSMOquick 0.0015533516549169554 COSMOtherm 0.0628509977297168 Cantera 0.0 Catalyst 0.11315569363125821 Classical Simulations 1.0 Conformers 7.169315330385948E-4 Crystallization 0.07085673318198112 DFTB Plus 0.005496475086629227 DMol3 0.16788146731987094 DPD 0.0021507945991157845 Discover 0.0033456804875134426 Forcite 0.5329191062253554 GULP 0.021866411757677142 Kinetix 2.389771776795316E-4 LUDI 0.0035846576651929743 LibDock 0.07133468753734018 LigandFit 0.004301589198231569 MCSS 4.779543553590632E-4 MODELER 0.2128091767236229 MesoDyn 8.364201218783606E-4 Mesocite 0.003106703309833911 Mesoscale 0.005735452264308758 Modules 0.0 Morphology 0.01648942525988768 ONETEP 0.0010753972995578922 Polymorph 0.002031306010276019 QMERA 1.194885888397658E-4 QSAR 8.364201218783606E-4 Quantum Mechanics 0.5324411518699964 Reflex 0.05138009320109929 Reflex Plus 0.0010753972995578922 Semi-empirical 0.006930338152706416 Sorption 0.056876568287728524 Synthia 0.0013143744772374237 TURBOMOLE 4.779543553590632E-4 VAMP 0.0010753972995578922 Visualization 0.8137172899988051 X-Cell 0.0015533516549169554 ZDOCK 0.027721352610825666

Year

2022 0.0 2023 0.2593340060544904 2024 0.483992294284928 2025 1.0 2026 0.3904228969819283 2027 5.504082194294101E-4

Keywords

target 1.0 potential 0.2941082548299537 docking 0.22869764223747938 analysis 0.20437490020756827 visualization 0.20112831976156262 between 0.15610197455958275 novel 0.1040502421629677 energy 0.0856352120921816 binding 0.07525679919101602 promising 0.06998775879503966 cell 0.06306881686092927 activity 0.05561764862419501 stability 0.040236308478365 performance 0.03235935919953164 interaction 0.032040023417957315 synthesized 0.0295385597956251 experimental 0.02645164724040662 including 0.02123582947469264 development 0.020703603172068763 effective 0.020650380541806377 mechanism 0.019213369524721913 protein 0.018681143222098035 synthesis 0.01048485816169035 design 0.002235350471020278 enhanced 0.0
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