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Application

Discovery Studio 0.8725221342944449 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06850327211315178 Amorphous Cell 0.2891070297656745 Blends 0.002427696854549293 CASTEP 0.4023643656322567 CDOCKER 0.15452818239392022 CHARMm 0.23696432341144183 COMPASS 0.3748152839349799 COMPASS III 0.08496938990922524 COSMObase 0.0032721131517838295 COSMOconf 0.004433185560481318 COSMOmic 2.1110407430863416E-4 COSMOperm 0.001266624445851805 COSMOplex 3.1665611146295124E-4 COSMOquick 0.001477728520160439 COSMOtherm 0.06618112729575681 Cantera 0.0 Catalyst 0.10745197382309478 Classical Simulations 1.0 Conformers 5.277601857715853E-4 Crystallization 0.07610301878826262 DFTB Plus 0.006016466117796073 DMol3 0.1810217437196538 DPD 0.0030610090774751955 Discover 0.004010977411864049 Forcite 0.5522482583913869 GULP 0.022799240025332488 Kinetix 2.1110407430863416E-4 LUDI 0.004010977411864049 LibDock 0.06459784673844206 LigandFit 0.00506649778340722 MCSS 4.222081486172683E-4 MODELER 0.18534937724298078 MesoDyn 0.0010555203715431707 Mesocite 0.0037998733375554147 Mesoscale 0.006966434452184927 Modules 0.0 Morphology 0.017943846316233903 ONETEP 0.001161072408697488 Polymorph 0.0021110407430863414 QMERA 2.1110407430863416E-4 QSAR 0.001266624445851805 Quantum Mechanics 0.5721975934135529 Reflex 0.05541481950601647 Reflex Plus 9.499683343888537E-4 Semi-empirical 0.007705298712265146 Sorption 0.05573147561747942 Synthia 0.001372176483006122 TURBOMOLE 5.277601857715853E-4 VAMP 0.001266624445851805 Visualization 0.7524804728731265 X-Cell 0.001266624445851805 ZDOCK 0.02744352966012244

Year

2021 0.002617039837161966 2022 0.14703886788795192 2023 0.21217408161287196 2024 0.7250169622952408 2025 1.0 2026 0.4118445284481923 2027 0.0

Keywords

target 1.0 potential 0.27001279681501494 docking 0.19489075311626144 analysis 0.18768662021896773 visualization 0.17858666287501776 between 0.15849092374046164 novel 0.09602350822313854 energy 0.09526517844447605 cell 0.06749135030096214 binding 0.06303616285131997 promising 0.05967107445850514 activity 0.04521541305275131 stability 0.0387696099341201 performance 0.036352433764633395 experimental 0.03203943314849045 interaction 0.029764443812502962 synthesized 0.027252476420683444 effective 0.02151760746954832 mechanism 0.020759277690885824 including 0.01620929901891085 development 0.015924925351912412 synthesis 0.007441110953125741 protein 0.005734868951135125 design 0.0025593630029859234 chemical 0.0
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