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Application

Discovery Studio 0.9090850223402188 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06949197157146618 Amorphous Cell 0.2835833991401246 Blends 0.0026322716504343247 CASTEP 0.41045889269105906 CDOCKER 0.15688339036588575 CHARMm 0.24278318855839257 COMPASS 0.37544967974028254 COMPASS III 0.07967008861981223 COSMObase 0.0032464683688690006 COSMOconf 0.0037729226989558656 COSMOmic 1.7548477669562167E-4 COSMOperm 0.0012283934368693516 COSMOplex 2.6322716504343247E-4 COSMOquick 0.0014038782135649733 COSMOtherm 0.06387645871720628 Cantera 8.774238834781083E-5 Catalyst 0.11660963411424059 Classical Simulations 1.0 Conformers 9.651662718259191E-4 Crystallization 0.07651136263929104 DFTB Plus 0.005966482407651136 DMol3 0.18741774151092394 DPD 0.002895498815477757 Discover 0.004123892252347109 Forcite 0.5454066859699921 GULP 0.026059489339299816 Kinetix 2.6322716504343247E-4 LUDI 0.004474861805738352 LibDock 0.06633324559094499 LigandFit 0.005615512854259893 MCSS 9.651662718259191E-4 MODELER 0.17320347459857857 MesoDyn 0.001491620601912784 Mesocite 0.0040361498639992985 Mesoscale 0.007458103009563921 Modules 0.0 Morphology 0.017899447222953408 ONETEP 0.0010529086601737299 Polymorph 0.0019303325436518383 QMERA 2.6322716504343247E-4 QSAR 0.0011406510485215409 Quantum Mechanics 0.5860314117750285 Reflex 0.05615512854259893 Reflex Plus 7.896814951302974E-4 Semi-empirical 0.008160042116346407 Sorption 0.05668158287268579 Synthia 0.0016671053786084058 TURBOMOLE 6.141967184346758E-4 VAMP 0.0017548477669562166 Visualization 0.8028428533824691 X-Cell 0.0012283934368693516 ZDOCK 0.027638852329560412

Year

2021 0.012181228639032513 2022 0.15958285864516694 2023 0.3670142844623609 2024 0.8638156165103847 2025 1.0 2026 0.3725352729822102 2027 0.0

Keywords

target 1.0 potential 0.267402376910017 docking 0.20296342028090755 visualization 0.19350980089519987 analysis 0.18224263003549931 between 0.15581108195709215 novel 0.09658126254051551 energy 0.09229819416576632 binding 0.06258681895354222 cell 0.060696095076400676 promising 0.05016206204661213 activity 0.044374131810464575 interaction 0.03553789164994598 stability 0.03245099552400062 experimental 0.03110047846889952 performance 0.02812934094767711 synthesized 0.02762772032721099 effective 0.01801975613520605 mechanism 0.01763389411946288 development 0.015704584040747028 including 0.011344343262849206 protein 0.011344343262849206 synthesis 0.007987343725883623 chemical 0.001967896280290168 design 0.0
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