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Application

Discovery Studio 1.0 Materials Studio 0.9644652650822669 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06817287254979139 Amorphous Cell 0.27489569393056756 Blends 0.0027552546642525388 CASTEP 0.4073840825001968 CDOCKER 0.17704479256868455 CHARMm 0.26135558529481223 COMPASS 0.3721168227977643 COMPASS III 0.07447059749665433 COSMObase 0.0029914193497598994 COSMOconf 0.00346374872077462 COSMOmic 2.3616468550736045E-4 COSMOperm 0.0013382665512083759 COSMOplex 3.936078091789341E-4 COSMOquick 0.0015744312367157365 COSMOtherm 0.06289852790679368 Cantera 0.0 Catalyst 0.12587577737542313 Classical Simulations 1.0 Conformers 9.446587420294418E-4 Crystallization 0.0758875856096985 DFTB Plus 0.0056679524521766516 DMol3 0.186491379988979 DPD 0.0032275840352672595 Discover 0.004644572148311423 Forcite 0.5304258836495316 GULP 0.026135558529481226 Kinetix 2.3616468550736045E-4 LUDI 0.005431787766669291 LibDock 0.0722663937652523 LigandFit 0.007478548374399748 MCSS 0.001259544989372589 MODELER 0.18956152090057465 MesoDyn 0.0015744312367157365 Mesocite 0.004408407462804062 Mesoscale 0.007950877745414468 Modules 0.0 Morphology 0.017633629851216248 ONETEP 0.0013382665512083759 Polymorph 0.0018893174840588836 QMERA 2.3616468550736045E-4 QSAR 0.001259544989372589 Quantum Mechanics 0.5818310635283004 Reflex 0.056049752027080214 Reflex Plus 7.084940565220814E-4 Semi-empirical 0.007714713059907109 Sorption 0.05439659922852869 Synthia 0.0014169881130441629 TURBOMOLE 4.723293710147209E-4 VAMP 0.0016531527985515233 Visualization 0.89144296622845 X-Cell 0.001259544989372589 ZDOCK 0.03148862473431473

Year

2020 0.020129529144057412 2021 0.1509714685804306 2022 0.29704183441274284 2023 0.4318221599859968 2024 0.9466129879222825 2025 1.0 2026 0.3720462103973394 2027 0.0

Keywords

target 1.0 potential 0.26256281407035176 docking 0.2178656440095213 visualization 0.21416291986247024 analysis 0.17825971965088602 between 0.15078682888124834 novel 0.09898175085956096 energy 0.08033588997619677 binding 0.07041787886802434 cell 0.05666490346469188 activity 0.05190425813276911 promising 0.044201269505421845 interaction 0.03864718328484528 synthesized 0.027505950806664903 stability 0.026514149695847658 experimental 0.026448029621793177 protein 0.020364982808780747 mechanism 0.01712509918011108 effective 0.016496958476593493 development 0.01573657762496694 performance 0.013786035440359693 synthesis 0.012628934144406242 including 0.007736048664374504 design 4.95900555408622E-4 chemical 0.0
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