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Application

Discovery Studio 1.0 Materials Studio 0.9693501348153855 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06672719019518839 Amorphous Cell 0.27583598123770614 Blends 0.0027235587834770767 CASTEP 0.41125737630503856 CDOCKER 0.17884702678166137 CHARMm 0.2615372976244515 COMPASS 0.37138750189136027 COMPASS III 0.07338477833257678 COSMObase 0.002874867604781359 COSMOconf 0.003404448479346346 COSMOmic 2.2696323195642307E-4 COSMOperm 0.0012861249810863973 COSMOplex 3.026176426085641E-4 COSMOquick 0.0014374338023906794 COSMOtherm 0.06377666817975489 Cantera 7.565441065214103E-5 Catalyst 0.12392192464820699 Classical Simulations 1.0 Conformers 0.0012861249810863973 Crystallization 0.07595702829474958 DFTB Plus 0.006052352852171282 DMol3 0.1879255560599183 DPD 0.0029505220154334997 Discover 0.004917536692389166 Forcite 0.5306400363141172 GULP 0.026176426085640792 Kinetix 2.2696323195642307E-4 LUDI 0.005976698441519141 LibDock 0.07172038129822969 LigandFit 0.007641095475866243 MCSS 0.0014374338023906794 MODELER 0.19208654864578606 MesoDyn 0.0017400514449992435 Mesocite 0.0040853381752156154 Mesoscale 0.007716749886518384 Modules 0.0 Morphology 0.01777878650325314 ONETEP 9.078529278256923E-4 Polymorph 0.0019670146769556664 QMERA 2.2696323195642307E-4 QSAR 0.0014374338023906794 Quantum Mechanics 0.5866243001967014 Reflex 0.055908609471932214 Reflex Plus 6.808896958692692E-4 Semi-empirical 0.008170676350431231 Sorption 0.054622484490845814 Synthia 0.0013617793917385383 TURBOMOLE 6.052352852171282E-4 VAMP 0.0017400514449992435 Visualization 0.8925707368739597 X-Cell 0.0011348161597821154 ZDOCK 0.03056438190346497

Year

2020 0.027490807214148136 2021 0.20127823498511643 2022 0.30196112764839783 2023 0.4557870775696025 2024 0.995534932586237 2025 1.0 2026 0.3721765014883558 2027 0.0

Keywords

target 1.0 potential 0.2602357713271644 docking 0.21596526809481556 visualization 0.21368361008999873 analysis 0.17749397895804284 between 0.1493852199264799 novel 0.09820636329065788 energy 0.08026999619723665 binding 0.06895677525668653 cell 0.05580555203447839 activity 0.05140068449740145 promising 0.04119660286474838 interaction 0.038566358220306754 synthesized 0.02722144758524528 experimental 0.026619343389529725 stability 0.024432754468246925 protein 0.018950437317784258 mechanism 0.016161744200785904 effective 0.014228672835593864 development 0.014133603752059831 performance 0.012739257193560654 synthesis 0.011661807580174927 including 0.006813284319939156 chemical 0.0011725186969197617 design 0.0
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